7-methyl-3-(3-oxo-3-pyrrolidin-1-ylpropyl)-1H-quinolin-2-one

C17H20N2O2 — CID 53174869

IUPAC7-methyl-3-(3-oxo-3-pyrrolidin-1-ylpropyl)-1H-quinolin-2-one
SMILESCc1ccc2cc(CCC(=O)N3CCCC3)c(=O)[nH]c2c1
InChIInChI=1S/C17H20N2O2/c1-12-4-5-13-11-14(17(21)18-15(13)10-12)6-7-16(20)19-8-2-3-9-19/h4-5,10-11H,2-3,6-9H2,1H3,(H,18,21)
InChIKeyICLFJPWUOSUOFF-UHFFFAOYSA-N
MW284.36 g/mol
LogP2.39
Rot. Bonds3

About 7-methyl-3-(3-oxo-3-pyrrolidin-1-ylpropyl)-1H-quinolin-2-one

7-methyl-3-(3-oxo-3-pyrrolidin-1-ylpropyl)-1H-quinolin-2-one (PubChem CID 53174869) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is 7-methyl-3-(3-oxo-3-pyrrolidin-1-ylpropyl)-1H-quinolin-2-one.

Molecular Properties

Compound Name7-methyl-3-(3-oxo-3-pyrrolidin-1-ylpropyl)-1H-quinolin-2-one
PubChem CID53174869
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC Name7-methyl-3-(3-oxo-3-pyrrolidin-1-ylpropyl)-1H-quinolin-2-one
SMILESCc1ccc2cc(CCC(=O)N3CCCC3)c(=O)[nH]c2c1
InChIInChI=1S/C17H20N2O2/c1-12-4-5-13-11-14(17(21)18-15(13)10-12)6-7-16(20)19-8-2-3-9-19/h4-5,10-11H,2-3,6-9H2,1H3,(H,18,21)
InChIKeyICLFJPWUOSUOFF-UHFFFAOYSA-N
XLogP2.39
TPSA53.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

7-methyl-3-[3-oxo-3-(4-propylpiperazin-1-yl)propyl]-1H-quinolin-2-one
CID 53174829
3-[3-[4-(2,2-dimethylpropyl)piperazin-1-yl]-3-oxopropyl]-7-methyl-1H-quinolin-2-one
CID 110629324
3-[3-[4-(methoxymethyl)piperidin-1-yl]-3-oxopropyl]-7-methyl-1H-quinolin-2-one
CID 53174835
5,7-dimethyl-3-(3-oxo-3-piperidin-1-ylpropyl)-1H-quinolin-2-one
CID 110331696
3-[3-(4-ethylpiperazin-1-yl)-3-oxopropyl]-6-methyl-1H-quinolin-2-one
CID 53174689
4-[3-(6-methyl-2-oxo-1H-quinolin-3-yl)propanoyl]piperazine-1-carbaldehyde
CID 110331208
7-methyl-3-[3-[2-(morpholine-4-carbonyl)pyrrolidin-1-yl]-3-oxopropyl]-1H-quinolin-2-one
CID 110424937
ethyl 4-[3-(7-methoxy-2-oxo-1H-quinolin-3-yl)propanoyl]piperazine-1-carboxylate
CID 110298870
3-[3-[4-(3-methylphenyl)piperazin-1-yl]-3-oxopropyl]-1H-quinolin-2-one
CID 110330988
7-methyl-3-[[3-(pyrrolidine-1-carbonyl)piperidin-1-yl]methyl]-1H-quinolin-2-one
CID 56751376
1-(azepan-1-yl)-3-(6-methyl-1H-benzimidazol-2-yl)propan-1-one
CID 6501370
N-[2-(2-ethylpiperidin-1-yl)ethyl]-3-(7-methyl-2-oxo-1H-quinolin-3-yl)propanamide
CID 53174888

Frequently Asked Questions

What is the IUPAC name of 7-methyl-3-(3-oxo-3-pyrrolidin-1-ylpropyl)-1H-quinolin-2-one?
The IUPAC name of 7-methyl-3-(3-oxo-3-pyrrolidin-1-ylpropyl)-1H-quinolin-2-one (CID 53174869) is 7-methyl-3-(3-oxo-3-pyrrolidin-1-ylpropyl)-1H-quinolin-2-one.
What is the SMILES notation for 7-methyl-3-(3-oxo-3-pyrrolidin-1-ylpropyl)-1H-quinolin-2-one?
The canonical SMILES for 7-methyl-3-(3-oxo-3-pyrrolidin-1-ylpropyl)-1H-quinolin-2-one is Cc1ccc2cc(CCC(=O)N3CCCC3)c(=O)[nH]c2c1.
What is the InChIKey of 7-methyl-3-(3-oxo-3-pyrrolidin-1-ylpropyl)-1H-quinolin-2-one?
The InChIKey is ICLFJPWUOSUOFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-12-4-5-13-11-14(17(21)18-15(13)10-12)6-7-16(20)19-8-2-3-9-19/h4-5,10-11H,2-3,6-9H2,1H3,(H,18,21).
What are the key properties of 7-methyl-3-(3-oxo-3-pyrrolidin-1-ylpropyl)-1H-quinolin-2-one?
7-methyl-3-(3-oxo-3-pyrrolidin-1-ylpropyl)-1H-quinolin-2-one has a molecular weight of 284.36 g/mol, XLogP of 2.39, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-3-(3-oxo-3-pyrrolidin-1-ylpropyl)-1H-quinolin-2-one is sourced from PubChem (CID 53174869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).