| CAS Number | 713519-97-2 |
| Catalog Number | AG00FBK3(AGN-PC-07ADXV) |
| Chemical Name | N-Cyclopropyl-1-methylpyrrole-2-carboxamide |
| IUPAC Name | N-cyclopropyl-1-methylpyrrole-2-carboxamide |
| InChI | InChI=1S/C9H12N2O/c1-11-6-2-3-8(11)9(12)10-7-4-5-7/h2-3,6-7H,4-5H2,1H3,(H,10,12) |
| InChI Key | LWTAXLQSPPABBU-UHFFFAOYSA-N |
| MDL Number | MFCD17015782 |
| Molecular Formula | C9H12N2O |
| Molecular Weight | 164.2044 |
| SMILES | O=C(c1cccn1C)NC1CC1 |
| Synonyms | 713519-97-2,
N-Cyclopropyl-1-methyl-1H-pyrrole-2-carboxamide,
N-CYCLOPROPYL-1-METHYLPYRROLE-2-CARBOXAMIDE,
ACMC-209oi9,
SCHEMBL5656062,
CTK8B2216,
DTXSID30666350,
1081AC,
ANW-36031,
MFCD17015782,
ZINC39081949,
AKOS006227740,
AJ-98055,
TR-023483,
B-3985,
I11-684,
1H-Pyrrole-2-carboxamide,N-cyclopropyl-1-methyl-(9CI),
C9H12N2O,
1H-Pyrrole-2-carboxamide, N-cyclopropyl-1-methyl- (9CI),
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| Complexity | 189 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 164.095g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 164.208g/mol |
| Monoisotopic Mass | 164.095g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 34A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.8 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
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