3-methyl-4-(pyrrolidine-1-carbonyl)-1H-quinolin-2-one

C15H16N2O2 — CID 131849523

IUPAC3-methyl-4-(pyrrolidine-1-carbonyl)-1H-quinolin-2-one
SMILESCc1c(C(=O)N2CCCC2)c2ccccc2[nH]c1=O
InChIInChI=1S/C15H16N2O2/c1-10-13(15(19)17-8-4-5-9-17)11-6-2-3-7-12(11)16-14(10)18/h2-3,6-7H,4-5,8-9H2,1H3,(H,16,18)
InChIKeyZPQQSHHSEFDCSZ-UHFFFAOYSA-N
MW256.31 g/mol
LogP2.07
Rot. Bonds1

About 3-methyl-4-(pyrrolidine-1-carbonyl)-1H-quinolin-2-one

3-methyl-4-(pyrrolidine-1-carbonyl)-1H-quinolin-2-one (PubChem CID 131849523) has the molecular formula C15H16N2O2 and a molecular weight of 256.31 g/mol. Its IUPAC name is 3-methyl-4-(pyrrolidine-1-carbonyl)-1H-quinolin-2-one.

Molecular Properties

Compound Name3-methyl-4-(pyrrolidine-1-carbonyl)-1H-quinolin-2-one
PubChem CID131849523
Molecular FormulaC15H16N2O2
Molecular Weight256.31 g/mol
Exact Mass256.12
IUPAC Name3-methyl-4-(pyrrolidine-1-carbonyl)-1H-quinolin-2-one
SMILESCc1c(C(=O)N2CCCC2)c2ccccc2[nH]c1=O
InChIInChI=1S/C15H16N2O2/c1-10-13(15(19)17-8-4-5-9-17)11-6-2-3-7-12(11)16-14(10)18/h2-3,6-7H,4-5,8-9H2,1H3,(H,16,18)
InChIKeyZPQQSHHSEFDCSZ-UHFFFAOYSA-N
XLogP2.07
TPSA53.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-methyl-4-(pyrrolidine-1-carbonyl)-1H-quinolin-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

3-methyl-4-[4-[3-(trifluoromethyl)benzoyl]piperazine-1-carbonyl]-1H-quinolin-2-one
CID 154852591
4-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]-3-methyl-1H-quinolin-2-one
CID 45494575
4-methyl-3-[4-(methylamino)piperidine-1-carbonyl]-1H-quinolin-2-one
CID 119560721
3-methyl-2-oxo-N-propan-2-yl-1H-quinoline-4-carboxamide
CID 170238348
1-[4-(2-methyl-1H-indole-3-carbonyl)-1,4-diazepan-1-yl]propan-1-one
CID 110805781
ethyl 4-(2-methyl-1H-indole-3-carbonyl)-1,4-diazepane-1-carboxylate
CID 110809009
5-methyl-1-(4-methyl-2-oxo-1H-quinoline-3-carbonyl)piperidine-3-carboxylic acid
CID 122119684
1-(2-methyl-1H-indole-3-carbonyl)piperidine-3-carboxylic acid
CID 43355842
[1-(2-methyl-1H-indole-3-carbonyl)pyrrolidin-3-yl]-piperidin-1-ylmethanone
CID 110246452
2-(piperidine-1-carbonyl)-1H-quinolin-4-one
CID 47120448
2-ethyl-1-[4-(2-methyl-1H-indole-3-carbonyl)-1,4-diazepan-1-yl]butan-1-one
CID 110807639
(2-bromophenyl)-[4-(3-methyl-1H-indole-2-carbonyl)piperazin-1-yl]methanone
CID 53013272

Frequently Asked Questions

What is the IUPAC name of 3-methyl-4-(pyrrolidine-1-carbonyl)-1H-quinolin-2-one?
The IUPAC name of 3-methyl-4-(pyrrolidine-1-carbonyl)-1H-quinolin-2-one (CID 131849523) is 3-methyl-4-(pyrrolidine-1-carbonyl)-1H-quinolin-2-one.
What is the SMILES notation for 3-methyl-4-(pyrrolidine-1-carbonyl)-1H-quinolin-2-one?
The canonical SMILES for 3-methyl-4-(pyrrolidine-1-carbonyl)-1H-quinolin-2-one is Cc1c(C(=O)N2CCCC2)c2ccccc2[nH]c1=O.
What is the InChIKey of 3-methyl-4-(pyrrolidine-1-carbonyl)-1H-quinolin-2-one?
The InChIKey is ZPQQSHHSEFDCSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O2/c1-10-13(15(19)17-8-4-5-9-17)11-6-2-3-7-12(11)16-14(10)18/h2-3,6-7H,4-5,8-9H2,1H3,(H,16,18).
What are the key properties of 3-methyl-4-(pyrrolidine-1-carbonyl)-1H-quinolin-2-one?
3-methyl-4-(pyrrolidine-1-carbonyl)-1H-quinolin-2-one has a molecular weight of 256.31 g/mol, XLogP of 2.07, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-4-(pyrrolidine-1-carbonyl)-1H-quinolin-2-one is sourced from PubChem (CID 131849523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).