3-[[4-[(2R)-2-methyl-5-oxopyrrolidin-2-yl]phenyl]methyl]-1H-quinolin-2-one

C21H20N2O2 — CID 175839152

IUPAC3-[[4-[(2R)-2-methyl-5-oxopyrrolidin-2-yl]phenyl]methyl]-1H-quinolin-2-one
SMILESC[C@]1(c2ccc(Cc3cc4ccccc4[nH]c3=O)cc2)CCC(=O)N1
InChIInChI=1S/C21H20N2O2/c1-21(11-10-19(24)23-21)17-8-6-14(7-9-17)12-16-13-15-4-2-3-5-18(15)22-20(16)25/h2-9,13H,10-12H2,1H3,(H,22,25)(H,23,24)/t21-/m1/s1
InChIKeyGJOXNNVSTZOTHM-OAQYLSRUSA-N
MW332.40 g/mol
LogP3.24
Rot. Bonds3

About 3-[[4-[(2R)-2-methyl-5-oxopyrrolidin-2-yl]phenyl]methyl]-1H-quinolin-2-one

3-[[4-[(2R)-2-methyl-5-oxopyrrolidin-2-yl]phenyl]methyl]-1H-quinolin-2-one (PubChem CID 175839152) has the molecular formula C21H20N2O2 and a molecular weight of 332.40 g/mol. Its IUPAC name is 3-[[4-[(2R)-2-methyl-5-oxopyrrolidin-2-yl]phenyl]methyl]-1H-quinolin-2-one.

Molecular Properties

Compound Name3-[[4-[(2R)-2-methyl-5-oxopyrrolidin-2-yl]phenyl]methyl]-1H-quinolin-2-one
PubChem CID175839152
Molecular FormulaC21H20N2O2
Molecular Weight332.40 g/mol
Exact Mass332.15
IUPAC Name3-[[4-[(2R)-2-methyl-5-oxopyrrolidin-2-yl]phenyl]methyl]-1H-quinolin-2-one
SMILESC[C@]1(c2ccc(Cc3cc4ccccc4[nH]c3=O)cc2)CCC(=O)N1
InChIInChI=1S/C21H20N2O2/c1-21(11-10-19(24)23-21)17-8-6-14(7-9-17)12-16-13-15-4-2-3-5-18(15)22-20(16)25/h2-9,13H,10-12H2,1H3,(H,22,25)(H,23,24)/t21-/m1/s1
InChIKeyGJOXNNVSTZOTHM-OAQYLSRUSA-N
XLogP3.24
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.40
LogP ≤ 53.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 3-[[4-[(2R)-2-methyl-5-oxopyrrolidin-2-yl]phenyl]methyl]-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

ethane;3-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)methyl]-1H-quinolin-2-one
CID 166457788
3-[[4-(methylsulfanylmethyl)phenyl]methyl]-1H-quinolin-2-one
CID 166457923
3-[(2-acetyl-1,3-dihydroisoindol-5-yl)methyl]-1H-quinolin-2-one
CID 166457969
3-(2H-benzotriazol-5-ylmethyl)-1H-quinolin-2-one
CID 166457863
8-chloro-6-[(2-oxo-1H-quinolin-3-yl)methyl]-4H-1,4-benzoxazin-3-one
CID 166458027
3-[(1-oxo-2,3-dihydro-1-benzothiophen-6-yl)methyl]-1H-quinolin-2-one
CID 166457897
3-[[3-(4-methylpiperidin-4-yl)-1,2,4-oxadiazol-5-yl]methyl]-1H-quinolin-2-one
CID 166288471
3-[(1-methylindol-5-yl)methyl]-1H-quinolin-2-one
CID 167291231
N-[[2-methyl-4-[(2-oxo-1H-quinolin-3-yl)methyl]phenyl]methyl]methanesulfonamide
CID 167290973
3-[[4-(1-hydroxycyclobutyl)phenyl]methyl]-1H-1,6-naphthyridin-2-one
CID 166457978
3-[[(2,2,3,3-tetramethylcyclopropyl)amino]methyl]-1H-quinolin-2-one
CID 79358473
5-[(2-oxo-1H-quinolin-3-yl)methyl]pyrazolo[1,5-a]pyridine-3-carbonitrile
CID 166458088

Frequently Asked Questions

What is the IUPAC name of 3-[[4-[(2R)-2-methyl-5-oxopyrrolidin-2-yl]phenyl]methyl]-1H-quinolin-2-one?
The IUPAC name of 3-[[4-[(2R)-2-methyl-5-oxopyrrolidin-2-yl]phenyl]methyl]-1H-quinolin-2-one (CID 175839152) is 3-[[4-[(2R)-2-methyl-5-oxopyrrolidin-2-yl]phenyl]methyl]-1H-quinolin-2-one.
What is the SMILES notation for 3-[[4-[(2R)-2-methyl-5-oxopyrrolidin-2-yl]phenyl]methyl]-1H-quinolin-2-one?
The canonical SMILES for 3-[[4-[(2R)-2-methyl-5-oxopyrrolidin-2-yl]phenyl]methyl]-1H-quinolin-2-one is C[C@]1(c2ccc(Cc3cc4ccccc4[nH]c3=O)cc2)CCC(=O)N1.
What is the InChIKey of 3-[[4-[(2R)-2-methyl-5-oxopyrrolidin-2-yl]phenyl]methyl]-1H-quinolin-2-one?
The InChIKey is GJOXNNVSTZOTHM-OAQYLSRUSA-N. The full InChI is InChI=1S/C21H20N2O2/c1-21(11-10-19(24)23-21)17-8-6-14(7-9-17)12-16-13-15-4-2-3-5-18(15)22-20(16)25/h2-9,13H,10-12H2,1H3,(H,22,25)(H,23,24)/t21-/m1/s1.
What are the key properties of 3-[[4-[(2R)-2-methyl-5-oxopyrrolidin-2-yl]phenyl]methyl]-1H-quinolin-2-one?
3-[[4-[(2R)-2-methyl-5-oxopyrrolidin-2-yl]phenyl]methyl]-1H-quinolin-2-one has a molecular weight of 332.40 g/mol, XLogP of 3.24, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[4-[(2R)-2-methyl-5-oxopyrrolidin-2-yl]phenyl]methyl]-1H-quinolin-2-one is sourced from PubChem (CID 175839152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).