6-ethoxy-1-methyl-3-(pyrrolidine-1-carbonyl)quinolin-4-one

C17H20N2O3 — CID 30133978

IUPAC6-ethoxy-1-methyl-3-(pyrrolidine-1-carbonyl)quinolin-4-one
SMILESCCOc1ccc2c(c1)c(=O)c(C(=O)N1CCCC1)cn2C
InChIInChI=1S/C17H20N2O3/c1-3-22-12-6-7-15-13(10-12)16(20)14(11-18(15)2)17(21)19-8-4-5-9-19/h6-7,10-11H,3-5,8-9H2,1-2H3
InChIKeyULOHJFIMOXHEAJ-UHFFFAOYSA-N
MW300.36 g/mol
LogP2.17
Rot. Bonds3

About 6-ethoxy-1-methyl-3-(pyrrolidine-1-carbonyl)quinolin-4-one

6-ethoxy-1-methyl-3-(pyrrolidine-1-carbonyl)quinolin-4-one (PubChem CID 30133978) has the molecular formula C17H20N2O3 and a molecular weight of 300.36 g/mol. Its IUPAC name is 6-ethoxy-1-methyl-3-(pyrrolidine-1-carbonyl)quinolin-4-one.

Molecular Properties

Compound Name6-ethoxy-1-methyl-3-(pyrrolidine-1-carbonyl)quinolin-4-one
PubChem CID30133978
Molecular FormulaC17H20N2O3
Molecular Weight300.36 g/mol
Exact Mass300.15
IUPAC Name6-ethoxy-1-methyl-3-(pyrrolidine-1-carbonyl)quinolin-4-one
SMILESCCOc1ccc2c(c1)c(=O)c(C(=O)N1CCCC1)cn2C
InChIInChI=1S/C17H20N2O3/c1-3-22-12-6-7-15-13(10-12)16(20)14(11-18(15)2)17(21)19-8-4-5-9-19/h6-7,10-11H,3-5,8-9H2,1-2H3
InChIKeyULOHJFIMOXHEAJ-UHFFFAOYSA-N
XLogP2.17
TPSA51.54 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 52.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

6-ethoxy-1-methyl-3-(4-methylpiperazine-1-carbonyl)quinolin-4-one
CID 30133993
6-ethoxy-3-[4-(4-methoxyphenyl)piperazine-1-carbonyl]-1-methylquinolin-4-one
CID 30134004
3-(4-benzylpiperazine-1-carbonyl)-6-ethoxy-1-methylquinolin-4-one
CID 30133996
6-ethoxy-1-methyl-4-oxo-N-phenylquinoline-3-carboxamide
CID 30133870
6-ethoxy-1-methyl-N-(4-methylphenyl)-4-oxoquinoline-3-carboxamide
CID 30133873
6-ethoxy-1-methyl-4-oxo-N-[(2R)-pentan-2-yl]quinoline-3-carboxamide
CID 30134022
6-ethoxy-1-methyl-N-(2-morpholin-4-ylethyl)-4-oxoquinoline-3-carboxamide
CID 30134066
6-ethoxy-N-[(4-methoxyphenyl)methyl]-1-methyl-4-oxoquinoline-3-carboxamide
CID 30133854
6-ethoxy-1-methyl-4-oxo-N-(4-propan-2-ylphenyl)quinoline-3-carboxamide
CID 30133888
6-ethoxy-1-methyl-4-oxo-N-[(1R)-1-phenylethyl]quinoline-3-carboxamide
CID 30133856
1-methyl-6-morpholin-4-ylsulfonyl-3-(pyrrolidine-1-carbonyl)quinolin-4-one
CID 20859121
N-[1-(4-chlorophenyl)ethyl]-6-ethoxy-1-methyl-4-oxoquinoline-3-carboxamide
CID 43888799

Frequently Asked Questions

What is the IUPAC name of 6-ethoxy-1-methyl-3-(pyrrolidine-1-carbonyl)quinolin-4-one?
The IUPAC name of 6-ethoxy-1-methyl-3-(pyrrolidine-1-carbonyl)quinolin-4-one (CID 30133978) is 6-ethoxy-1-methyl-3-(pyrrolidine-1-carbonyl)quinolin-4-one.
What is the SMILES notation for 6-ethoxy-1-methyl-3-(pyrrolidine-1-carbonyl)quinolin-4-one?
The canonical SMILES for 6-ethoxy-1-methyl-3-(pyrrolidine-1-carbonyl)quinolin-4-one is CCOc1ccc2c(c1)c(=O)c(C(=O)N1CCCC1)cn2C.
What is the InChIKey of 6-ethoxy-1-methyl-3-(pyrrolidine-1-carbonyl)quinolin-4-one?
The InChIKey is ULOHJFIMOXHEAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O3/c1-3-22-12-6-7-15-13(10-12)16(20)14(11-18(15)2)17(21)19-8-4-5-9-19/h6-7,10-11H,3-5,8-9H2,1-2H3.
What are the key properties of 6-ethoxy-1-methyl-3-(pyrrolidine-1-carbonyl)quinolin-4-one?
6-ethoxy-1-methyl-3-(pyrrolidine-1-carbonyl)quinolin-4-one has a molecular weight of 300.36 g/mol, XLogP of 2.17, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethoxy-1-methyl-3-(pyrrolidine-1-carbonyl)quinolin-4-one is sourced from PubChem (CID 30133978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).