6-methyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)quinolin-4-one

C16H18N2O2 — CID 100742023

IUPAC6-methyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)quinolin-4-one
SMILESCc1ccc2c(c1)c(=O)ccn2CC(=O)N1CCCC1
InChIInChI=1S/C16H18N2O2/c1-12-4-5-14-13(10-12)15(19)6-9-18(14)11-16(20)17-7-2-3-8-17/h4-6,9-10H,2-3,7-8,11H2,1H3
InChIKeyTYZAKWUKAOQIPB-UHFFFAOYSA-N
MW270.33 g/mol
LogP1.93
Rot. Bonds2

About 6-methyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)quinolin-4-one

6-methyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)quinolin-4-one (PubChem CID 100742023) has the molecular formula C16H18N2O2 and a molecular weight of 270.33 g/mol. Its IUPAC name is 6-methyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)quinolin-4-one.

Molecular Properties

Compound Name6-methyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)quinolin-4-one
PubChem CID100742023
Molecular FormulaC16H18N2O2
Molecular Weight270.33 g/mol
Exact Mass270.14
IUPAC Name6-methyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)quinolin-4-one
SMILESCc1ccc2c(c1)c(=O)ccn2CC(=O)N1CCCC1
InChIInChI=1S/C16H18N2O2/c1-12-4-5-14-13(10-12)15(19)6-9-18(14)11-16(20)17-7-2-3-8-17/h4-6,9-10H,2-3,7-8,11H2,1H3
InChIKeyTYZAKWUKAOQIPB-UHFFFAOYSA-N
XLogP1.93
TPSA42.31 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.33
LogP ≤ 51.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

ethyl 1-[2-(6-methyl-4-oxoquinolin-1-yl)acetyl]piperidine-4-carboxylate
CID 100742059
1-[2-(azepan-1-yl)-2-oxoethyl]-6-fluoroquinolin-4-one
CID 100743617
1-[2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxoethyl]-6-methylquinolin-4-one
CID 100742188
5,7-dimethyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)quinolin-4-one
CID 100744816
2-(6-methyl-4-oxoquinolin-1-yl)-N-propan-2-ylacetamide
CID 100741082
6-chloro-1-[2-(4-ethylpiperazin-1-yl)-2-oxoethyl]quinolin-4-one
CID 100735726
6-chloro-1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]quinolin-4-one
CID 100735436
1-[2-(5-methylindol-1-yl)acetyl]piperidin-4-one
CID 63555836
N-(4-chlorophenyl)-2-(6-methyl-4-oxoquinolin-1-yl)acetamide
CID 100741578
2-(6-methylindol-1-yl)-1-(4-methylpiperazin-1-yl)ethanone
CID 116546775
1-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-6-bromoquinolin-4-one
CID 100737310
N-(2,3-dimethylphenyl)-2-(6-methyl-4-oxoquinolin-1-yl)acetamide
CID 100741423

Frequently Asked Questions

What is the IUPAC name of 6-methyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)quinolin-4-one?
The IUPAC name of 6-methyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)quinolin-4-one (CID 100742023) is 6-methyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)quinolin-4-one.
What is the SMILES notation for 6-methyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)quinolin-4-one?
The canonical SMILES for 6-methyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)quinolin-4-one is Cc1ccc2c(c1)c(=O)ccn2CC(=O)N1CCCC1.
What is the InChIKey of 6-methyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)quinolin-4-one?
The InChIKey is TYZAKWUKAOQIPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O2/c1-12-4-5-14-13(10-12)15(19)6-9-18(14)11-16(20)17-7-2-3-8-17/h4-6,9-10H,2-3,7-8,11H2,1H3.
What are the key properties of 6-methyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)quinolin-4-one?
6-methyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)quinolin-4-one has a molecular weight of 270.33 g/mol, XLogP of 1.93, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)quinolin-4-one is sourced from PubChem (CID 100742023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).