1,3-dimethyl-6-pyrrolidin-1-ylquinolin-2-one

C15H18N2O — CID 168514090

IUPAC1,3-dimethyl-6-pyrrolidin-1-ylquinolin-2-one
SMILESCc1cc2cc(N3CCCC3)ccc2n(C)c1=O
InChIInChI=1S/C15H18N2O/c1-11-9-12-10-13(17-7-3-4-8-17)5-6-14(12)16(2)15(11)18/h5-6,9-10H,3-4,7-8H2,1-2H3
InChIKeyQVLOAPPBHFCZMD-UHFFFAOYSA-N
MW242.32 g/mol
LogP2.45
Rot. Bonds1

About 1,3-dimethyl-6-pyrrolidin-1-ylquinolin-2-one

1,3-dimethyl-6-pyrrolidin-1-ylquinolin-2-one (PubChem CID 168514090) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is 1,3-dimethyl-6-pyrrolidin-1-ylquinolin-2-one.

Molecular Properties

Compound Name1,3-dimethyl-6-pyrrolidin-1-ylquinolin-2-one
PubChem CID168514090
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC Name1,3-dimethyl-6-pyrrolidin-1-ylquinolin-2-one
SMILESCc1cc2cc(N3CCCC3)ccc2n(C)c1=O
InChIInChI=1S/C15H18N2O/c1-11-9-12-10-13(17-7-3-4-8-17)5-6-14(12)16(2)15(11)18/h5-6,9-10H,3-4,7-8H2,1-2H3
InChIKeyQVLOAPPBHFCZMD-UHFFFAOYSA-N
XLogP2.45
TPSA25.24 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 52.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1,3-dimethyl-6-pyrrolidin-1-ylquinolin-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-bromo-1-methyl-3-piperidin-1-ylquinolin-2-one
CID 135007599
9-methyl-3-pyrrolidin-1-ylcarbazole
CID 123822276
2-methyl-4-pyrrolidin-1-ylphenol;hydrobromide
CID 154577359
2-methyl-4-pyrrolidin-1-ylbenzaldehyde
CID 958834
1-(10-pyrrolidin-1-ylpicen-3-yl)pyrrolidine
CID 58426575
2-methyl-4-pyrrolidin-1-ylaniline;dihydrochloride
CID 47002820
1-methyl-6-pyrrolidin-1-ylindazole
CID 123532355
6-pyrrolidin-1-ylchromen-2-one
CID 168512411
2-methyl-5-pyrrolidin-1-ylbenzenesulfonamide
CID 168515790
2-methyl-6-piperidin-1-ylquinoline
CID 82242491
1,4,6-trimethyl-2-oxo-N-(4-piperidin-1-ylphenyl)pyridine-3-carboxamide
CID 110862214
2-naphthalen-2-yl-5-pyrrolidin-1-ylisoindole-1,3-dione
CID 168514746

Frequently Asked Questions

What is the IUPAC name of 1,3-dimethyl-6-pyrrolidin-1-ylquinolin-2-one?
The IUPAC name of 1,3-dimethyl-6-pyrrolidin-1-ylquinolin-2-one (CID 168514090) is 1,3-dimethyl-6-pyrrolidin-1-ylquinolin-2-one.
What is the SMILES notation for 1,3-dimethyl-6-pyrrolidin-1-ylquinolin-2-one?
The canonical SMILES for 1,3-dimethyl-6-pyrrolidin-1-ylquinolin-2-one is Cc1cc2cc(N3CCCC3)ccc2n(C)c1=O.
What is the InChIKey of 1,3-dimethyl-6-pyrrolidin-1-ylquinolin-2-one?
The InChIKey is QVLOAPPBHFCZMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c1-11-9-12-10-13(17-7-3-4-8-17)5-6-14(12)16(2)15(11)18/h5-6,9-10H,3-4,7-8H2,1-2H3.
What are the key properties of 1,3-dimethyl-6-pyrrolidin-1-ylquinolin-2-one?
1,3-dimethyl-6-pyrrolidin-1-ylquinolin-2-one has a molecular weight of 242.32 g/mol, XLogP of 2.45, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethyl-6-pyrrolidin-1-ylquinolin-2-one is sourced from PubChem (CID 168514090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).