| CAS Number | 1343120-12-6 |
| Catalog Number | AG01BD3Q(AGN-PC-0WOWM4) |
| Chemical Name | [2-(4-methylpiperazin-1-yl)pyrimidin-4-yl]methanamine |
| IUPAC Name | [2-(4-methylpiperazin-1-yl)pyrimidin-4-yl]methanamine |
| InChI | InChI=1S/C10H17N5/c1-14-4-6-15(7-5-14)10-12-3-2-9(8-11)13-10/h2-3H,4-8,11H2,1H3 |
| InChI Key | BIQCBPGYBSLAOL-UHFFFAOYSA-N |
| MDL Number | MFCD16866313 |
| Molecular Formula | C10H17N5 |
| Molecular Weight | 207.2755 |
| SMILES | CN1CCN(C2=NC(CN)=CC=N2)CC1 |
| Synonyms | 1343120-12-6,
[2-(4-methylpiperazin-1-yl)pyrimidin-4-yl]methanamine,
(2-(4-Methylpiperazin-1-yl)pyrimidin-4-yl)methanamine,
ZINC54791043,
AKOS012043009,
NE48617,
2-(4-Methyl-1-piperazinyl)pyrimidine-4-methanamine,
Z2065616394,
|
| Complexity | 190 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 207.148g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 207.281g/mol |
| Monoisotopic Mass | 207.148g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 58.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.6 |
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Certificate of Analysis
Lot Number