N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)piperidine-4-carboxamide;hydrochloride

C17H24ClN3O2 — CID 119336511

IUPACN-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)piperidine-4-carboxamide;hydrochloride
SMILESCC1CC(NC(=O)C2CCNCC2)C(=O)N1c1ccccc1.Cl
InChIInChI=1S/C17H23N3O2.ClH/c1-12-11-15(19-16(21)13-7-9-18-10-8-13)17(22)20(12)14-5-3-2-4-6-14;/h2-6,12-13,15,18H,7-11H2,1H3,(H,19,21);1H
InChIKeyRBLOSVHVBJJVKP-UHFFFAOYSA-N
MW337.85 g/mol
LogP1.72
Rot. Bonds3

About N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)piperidine-4-carboxamide;hydrochloride

N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)piperidine-4-carboxamide;hydrochloride (PubChem CID 119336511) has the molecular formula C17H24ClN3O2 and a molecular weight of 337.85 g/mol. Its IUPAC name is N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)piperidine-4-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)piperidine-4-carboxamide;hydrochloride
PubChem CID119336511
Molecular FormulaC17H24ClN3O2
Molecular Weight337.85 g/mol
Exact Mass337.16
IUPAC NameN-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)piperidine-4-carboxamide;hydrochloride
SMILESCC1CC(NC(=O)C2CCNCC2)C(=O)N1c1ccccc1.Cl
InChIInChI=1S/C17H23N3O2.ClH/c1-12-11-15(19-16(21)13-7-9-18-10-8-13)17(22)20(12)14-5-3-2-4-6-14;/h2-6,12-13,15,18H,7-11H2,1H3,(H,19,21);1H
InChIKeyRBLOSVHVBJJVKP-UHFFFAOYSA-N
XLogP1.72
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.85
LogP ≤ 51.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)cyclohexane-1-carboxamide
CID 119806294
(2R,4R)-4-hydroxy-N-[(3S,5R)-5-methyl-2-oxo-1-phenylpyrrolidin-3-yl]pyrrolidine-2-carboxamide
CID 125152093
cis-(1S,3R)-2,2-dimethyl-3-[(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)carbamoyl]cyclopropane-1-carboxylic acid
CID 122065674
(2R,3S)-2-methyl-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)morpholine-3-carboxamide
CID 120935420
N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119806323
3-amino-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)propanamide;hydrochloride
CID 119336507
5-methyl-N-[(3R,5R)-5-methyl-2-oxo-1-phenylpyrrolidin-3-yl]-1-piperidin-4-yltriazole-4-carboxamide
CID 124691466
2-amino-2-methyl-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)pentanamide;hydrochloride
CID 119806331
1-[(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)carbamoyl]pyrrolidine-3-carboxylic acid
CID 122004000
(2R)-2-amino-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)propanamide
CID 119336526
3-methyl-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)but-2-enamide
CID 71998925
2-chloro-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)propanamide
CID 146085997

Frequently Asked Questions

What is the IUPAC name of N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)piperidine-4-carboxamide;hydrochloride?
The IUPAC name of N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)piperidine-4-carboxamide;hydrochloride (CID 119336511) is N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)piperidine-4-carboxamide;hydrochloride.
What is the SMILES notation for N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)piperidine-4-carboxamide;hydrochloride?
The canonical SMILES for N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)piperidine-4-carboxamide;hydrochloride is CC1CC(NC(=O)C2CCNCC2)C(=O)N1c1ccccc1.Cl.
What is the InChIKey of N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)piperidine-4-carboxamide;hydrochloride?
The InChIKey is RBLOSVHVBJJVKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O2.ClH/c1-12-11-15(19-16(21)13-7-9-18-10-8-13)17(22)20(12)14-5-3-2-4-6-14;/h2-6,12-13,15,18H,7-11H2,1H3,(H,19,21);1H.
What are the key properties of N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)piperidine-4-carboxamide;hydrochloride?
N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)piperidine-4-carboxamide;hydrochloride has a molecular weight of 337.85 g/mol, XLogP of 1.72, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)piperidine-4-carboxamide;hydrochloride is sourced from PubChem (CID 119336511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).