5-methyl-3-[(2S)-2-methylpyrrolidine-1-carbonyl]-6-propyl-1H-pyridin-2-one

C15H22N2O2 — CID 125483837

IUPAC5-methyl-3-[(2S)-2-methylpyrrolidine-1-carbonyl]-6-propyl-1H-pyridin-2-one
SMILESCCCc1[nH]c(=O)c(C(=O)N2CCC[C@@H]2C)cc1C
InChIInChI=1S/C15H22N2O2/c1-4-6-13-10(2)9-12(14(18)16-13)15(19)17-8-5-7-11(17)3/h9,11H,4-8H2,1-3H3,(H,16,18)/t11-/m0/s1
InChIKeyOCSRRBBODZGAKS-NSHDSACASA-N
MW262.35 g/mol
LogP2.26
Rot. Bonds3

About 5-methyl-3-[(2S)-2-methylpyrrolidine-1-carbonyl]-6-propyl-1H-pyridin-2-one

5-methyl-3-[(2S)-2-methylpyrrolidine-1-carbonyl]-6-propyl-1H-pyridin-2-one (PubChem CID 125483837) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 5-methyl-3-[(2S)-2-methylpyrrolidine-1-carbonyl]-6-propyl-1H-pyridin-2-one.

Molecular Properties

Compound Name5-methyl-3-[(2S)-2-methylpyrrolidine-1-carbonyl]-6-propyl-1H-pyridin-2-one
PubChem CID125483837
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name5-methyl-3-[(2S)-2-methylpyrrolidine-1-carbonyl]-6-propyl-1H-pyridin-2-one
SMILESCCCc1[nH]c(=O)c(C(=O)N2CCC[C@@H]2C)cc1C
InChIInChI=1S/C15H22N2O2/c1-4-6-13-10(2)9-12(14(18)16-13)15(19)17-8-5-7-11(17)3/h9,11H,4-8H2,1-3H3,(H,16,18)/t11-/m0/s1
InChIKeyOCSRRBBODZGAKS-NSHDSACASA-N
XLogP2.26
TPSA53.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 5-methyl-3-[(2S)-2-methylpyrrolidine-1-carbonyl]-6-propyl-1H-pyridin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-ethyl-5-methyl-3-[(2S)-2-methylpyrrolidine-1-carbonyl]-1H-pyridin-2-one
CID 125483849
[2-(ethylamino)-5-methylphenyl]-(2-methylpyrrolidin-1-yl)methanone
CID 62510499
5,6-dimethyl-3-[(2S)-2-(trifluoromethyl)pyrrolidine-1-carbonyl]-1H-pyridin-2-one
CID 97122691
3-chloro-2-methyl-5-[(2S)-2-methylpyrrolidine-1-carbonyl]-1H-pyridin-4-one
CID 166284324
[5-chloro-2-(ethylamino)-4-pyridinyl]-(2-methylpyrrolidin-1-yl)methanone
CID 114921368
(2-bromo-5-fluoro-4-methylphenyl)-(2-methylpyrrolidin-1-yl)methanone
CID 172913966
(2,5-dichloro-4-pyridinyl)-(2-methylpyrrolidin-1-yl)methanone
CID 114917342
(4-bromo-2-fluoro-5-methylphenyl)-(2-methylpiperidin-1-yl)methanone
CID 167312115
[(2S)-2-methylpiperidin-1-yl]-(5-propyl-1,2-oxazol-3-yl)methanone
CID 92719861
(5-bromo-2-methylphenyl)-(2-methylpiperidin-1-yl)methanone
CID 65308017
2-[(2,6-dichlorophenyl)methyl]-5-(2-methylpyrrolidine-1-carbonyl)-1H-pyrimidin-6-one
CID 70740218
(2-methylpyrrolidin-1-yl)-(5-methylthiophen-2-yl)methanone
CID 18711915

Frequently Asked Questions

What is the IUPAC name of 5-methyl-3-[(2S)-2-methylpyrrolidine-1-carbonyl]-6-propyl-1H-pyridin-2-one?
The IUPAC name of 5-methyl-3-[(2S)-2-methylpyrrolidine-1-carbonyl]-6-propyl-1H-pyridin-2-one (CID 125483837) is 5-methyl-3-[(2S)-2-methylpyrrolidine-1-carbonyl]-6-propyl-1H-pyridin-2-one.
What is the SMILES notation for 5-methyl-3-[(2S)-2-methylpyrrolidine-1-carbonyl]-6-propyl-1H-pyridin-2-one?
The canonical SMILES for 5-methyl-3-[(2S)-2-methylpyrrolidine-1-carbonyl]-6-propyl-1H-pyridin-2-one is CCCc1[nH]c(=O)c(C(=O)N2CCC[C@@H]2C)cc1C.
What is the InChIKey of 5-methyl-3-[(2S)-2-methylpyrrolidine-1-carbonyl]-6-propyl-1H-pyridin-2-one?
The InChIKey is OCSRRBBODZGAKS-NSHDSACASA-N. The full InChI is InChI=1S/C15H22N2O2/c1-4-6-13-10(2)9-12(14(18)16-13)15(19)17-8-5-7-11(17)3/h9,11H,4-8H2,1-3H3,(H,16,18)/t11-/m0/s1.
What are the key properties of 5-methyl-3-[(2S)-2-methylpyrrolidine-1-carbonyl]-6-propyl-1H-pyridin-2-one?
5-methyl-3-[(2S)-2-methylpyrrolidine-1-carbonyl]-6-propyl-1H-pyridin-2-one has a molecular weight of 262.35 g/mol, XLogP of 2.26, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-3-[(2S)-2-methylpyrrolidine-1-carbonyl]-6-propyl-1H-pyridin-2-one is sourced from PubChem (CID 125483837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).