| CAS Number | 52211-04-8 |
| Catalog Number | AG00DLDC(AGN-PC-043KD5) |
| Chemical Name | 1-Methyl-3-(piperidin-4-yl)imidazolidin-2-one |
| IUPAC Name | 1-methyl-3-piperidin-4-ylimidazolidin-2-one |
| InChI | InChI=1S/C9H17N3O/c1-11-6-7-12(9(11)13)8-2-4-10-5-3-8/h8,10H,2-7H2,1H3 |
| InChI Key | DWFGEKHJKFNGNW-UHFFFAOYSA-N |
| MDL Number | MFCD16992001 |
| Molecular Formula | C9H17N3O |
| Molecular Weight | 183.2508 |
| SMILES | CN1C(=O)N(C2CCNCC2)CC1 |
| Synonyms | 1-methyl-3-(piperidin-4-yl)imidazolidin-2-one,
52211-04-8,
2-Imidazolidinone, 1-methyl-3-(4-piperidinyl)-,
SCHEMBL2853627,
CTK1G3098,
DTXSID50634394,
DWFGEKHJKFNGNW-UHFFFAOYSA-N,
ZINC49454941,
AKOS011779737,
3-methyl-1-(4-piperidyl)-imidazolidin-2-one,
1-methyl-3-(4-piperidinyl)-2-imidazolidinone,
F8889-7378,
1-methyl-3-piperidin-4-ylimidazolidin-2-one,
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| Complexity | 201 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 183.137g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 183.255g/mol |
| Monoisotopic Mass | 183.137g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 35.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.4 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number