(2S)-N-(1-methyl-2-oxo-4-pyridinyl)pyrrolidine-2-carboxamide

C11H15N3O2 — CID 164573536

IUPAC(2S)-N-(1-methyl-2-oxo-4-pyridinyl)pyrrolidine-2-carboxamide
SMILESCn1ccc(NC(=O)[C@@H]2CCCN2)cc1=O
InChIInChI=1S/C11H15N3O2/c1-14-6-4-8(7-10(14)15)13-11(16)9-3-2-5-12-9/h4,6-7,9,12H,2-3,5H2,1H3,(H,13,16)/t9-/m0/s1
InChIKeyOIRANFXITCTLAK-VIFPVBQESA-N
MW221.26 g/mol
LogP0.08
Rot. Bonds2

About (2S)-N-(1-methyl-2-oxo-4-pyridinyl)pyrrolidine-2-carboxamide

(2S)-N-(1-methyl-2-oxo-4-pyridinyl)pyrrolidine-2-carboxamide (PubChem CID 164573536) has the molecular formula C11H15N3O2 and a molecular weight of 221.26 g/mol. Its IUPAC name is (2S)-N-(1-methyl-2-oxo-4-pyridinyl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name(2S)-N-(1-methyl-2-oxo-4-pyridinyl)pyrrolidine-2-carboxamide
PubChem CID164573536
Molecular FormulaC11H15N3O2
Molecular Weight221.26 g/mol
Exact Mass221.12
IUPAC Name(2S)-N-(1-methyl-2-oxo-4-pyridinyl)pyrrolidine-2-carboxamide
SMILESCn1ccc(NC(=O)[C@@H]2CCCN2)cc1=O
InChIInChI=1S/C11H15N3O2/c1-14-6-4-8(7-10(14)15)13-11(16)9-3-2-5-12-9/h4,6-7,9,12H,2-3,5H2,1H3,(H,13,16)/t9-/m0/s1
InChIKeyOIRANFXITCTLAK-VIFPVBQESA-N
XLogP0.08
TPSA63.13 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 50.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-N-(1-methyl-6-oxo-3-pyridinyl)pyrrolidine-2-carboxamide
CID 61178864
(2S)-N-(4-acetamidophenyl)pyrrolidine-2-carboxamide
CID 22691413
N-(3-aminophenyl)pyrrolidine-2-carboxamide
CID 110481304
N-(5-bromo-1-methyl-6-oxo-3-pyridinyl)pyrrolidine-2-carboxamide;hydrochloride
CID 119344897
N-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)pyrrolidine-2-carboxamide;hydrochloride
CID 119312607
(2S)-N-(3,5-dimethylphenyl)pyrrolidine-2-carboxamide;hydrochloride
CID 67505940
N-pyridin-4-ylpyrrolidine-2-carboxamide
CID 18072890
1-methyl-4-(pyrrolidine-2-carbonylamino)pyrrole-2-carboxamide
CID 119290226
N-(3,4-difluorophenyl)pyrrolidine-2-carboxamide
CID 18073046
N-(3-iodo-4-methylphenyl)pyrrolidine-2-carboxamide
CID 43233890
(2S)-N-(4-fluoro-3-methylphenyl)pyrrolidine-2-carboxamide
CID 62812681
N-(1,4-dimethyl-6-oxo-3-pyridinyl)piperidine-2-carboxamide
CID 119343326

Frequently Asked Questions

What is the IUPAC name of (2S)-N-(1-methyl-2-oxo-4-pyridinyl)pyrrolidine-2-carboxamide?
The IUPAC name of (2S)-N-(1-methyl-2-oxo-4-pyridinyl)pyrrolidine-2-carboxamide (CID 164573536) is (2S)-N-(1-methyl-2-oxo-4-pyridinyl)pyrrolidine-2-carboxamide.
What is the SMILES notation for (2S)-N-(1-methyl-2-oxo-4-pyridinyl)pyrrolidine-2-carboxamide?
The canonical SMILES for (2S)-N-(1-methyl-2-oxo-4-pyridinyl)pyrrolidine-2-carboxamide is Cn1ccc(NC(=O)[C@@H]2CCCN2)cc1=O.
What is the InChIKey of (2S)-N-(1-methyl-2-oxo-4-pyridinyl)pyrrolidine-2-carboxamide?
The InChIKey is OIRANFXITCTLAK-VIFPVBQESA-N. The full InChI is InChI=1S/C11H15N3O2/c1-14-6-4-8(7-10(14)15)13-11(16)9-3-2-5-12-9/h4,6-7,9,12H,2-3,5H2,1H3,(H,13,16)/t9-/m0/s1.
What are the key properties of (2S)-N-(1-methyl-2-oxo-4-pyridinyl)pyrrolidine-2-carboxamide?
(2S)-N-(1-methyl-2-oxo-4-pyridinyl)pyrrolidine-2-carboxamide has a molecular weight of 221.26 g/mol, XLogP of 0.08, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-(1-methyl-2-oxo-4-pyridinyl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 164573536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).