4-[1-(4-methoxyphenyl)imidazol-2-yl]-7-(2-oxopyrrolidin-1-yl)-3,4-dihydro-1H-quinolin-2-one

C23H22N4O3 — CID 170506240

IUPAC4-[1-(4-methoxyphenyl)imidazol-2-yl]-7-(2-oxopyrrolidin-1-yl)-3,4-dihydro-1H-quinolin-2-one
SMILESCOc1ccc(-n2ccnc2C2CC(=O)Nc3cc(N4CCCC4=O)ccc32)cc1
InChIInChI=1S/C23H22N4O3/c1-30-17-7-4-15(5-8-17)27-12-10-24-23(27)19-14-21(28)25-20-13-16(6-9-18(19)20)26-11-2-3-22(26)29/h4-10,12-13,19H,2-3,11,14H2,1H3,(H,25,28)
InChIKeySQOPMCZWHVPREE-UHFFFAOYSA-N
MW402.45 g/mol
LogP3.48
Rot. Bonds4

About 4-[1-(4-methoxyphenyl)imidazol-2-yl]-7-(2-oxopyrrolidin-1-yl)-3,4-dihydro-1H-quinolin-2-one

4-[1-(4-methoxyphenyl)imidazol-2-yl]-7-(2-oxopyrrolidin-1-yl)-3,4-dihydro-1H-quinolin-2-one (PubChem CID 170506240) has the molecular formula C23H22N4O3 and a molecular weight of 402.45 g/mol. Its IUPAC name is 4-[1-(4-methoxyphenyl)imidazol-2-yl]-7-(2-oxopyrrolidin-1-yl)-3,4-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name4-[1-(4-methoxyphenyl)imidazol-2-yl]-7-(2-oxopyrrolidin-1-yl)-3,4-dihydro-1H-quinolin-2-one
PubChem CID170506240
Molecular FormulaC23H22N4O3
Molecular Weight402.45 g/mol
Exact Mass402.17
IUPAC Name4-[1-(4-methoxyphenyl)imidazol-2-yl]-7-(2-oxopyrrolidin-1-yl)-3,4-dihydro-1H-quinolin-2-one
SMILESCOc1ccc(-n2ccnc2C2CC(=O)Nc3cc(N4CCCC4=O)ccc32)cc1
InChIInChI=1S/C23H22N4O3/c1-30-17-7-4-15(5-8-17)27-12-10-24-23(27)19-14-21(28)25-20-13-16(6-9-18(19)20)26-11-2-3-22(26)29/h4-10,12-13,19H,2-3,11,14H2,1H3,(H,25,28)
InChIKeySQOPMCZWHVPREE-UHFFFAOYSA-N
XLogP3.48
TPSA76.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500402.45
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(4R)-7-hydroxy-4-[1-(4-methoxyphenyl)imidazol-2-yl]-6-methyl-3,4-dihydro-1H-quinolin-2-one
CID 95120058
(4R)-7-(2-oxopyrrolidin-1-yl)-4-(2-phenylpyrazol-3-yl)-3,4-dihydro-1H-quinolin-2-one
CID 95134825
4-(1,3-benzothiazol-2-yl)-7-(2-oxopyrrolidin-1-yl)-3,4-dihydro-1H-quinolin-2-one
CID 169411339
formic acid;7-(2-oxopyrrolidin-1-yl)-4-[3-(trifluoromethyl)phenyl]-3,4-dihydro-1H-quinolin-2-one
CID 171339709
1-(4-methoxyphenyl)azepan-2-one
CID 66742326
1-[3-[3-(4-methoxyphenoxy)propoxy]phenyl]pyrrolidin-2-one
CID 39992148
(4S)-7-hydroxy-4-(4-methoxyphenyl)-3,4-dihydro-1H-quinolin-2-one
CID 95166951
(7S)-7-(2,4-dimethoxyphenyl)-1-(4-methoxyphenyl)-5-oxo-6,7-dihydro-4H-pyrrolo[3,2-b]pyridine-3-carboxylic acid
CID 51974398
7-(3-methyl-2-oxoimidazolidin-1-yl)-4-(1,3-thiazol-5-yl)-3,4-dihydro-1H-quinolin-2-one
CID 169422313
(4S)-4-(3-methoxyphenyl)-1,3,4,6,7,8-hexahydrocyclopenta[g]quinolin-2-one
CID 973945
1-(6,11-dihydro-5H-pyrido[3,2-c][1,5]benzodiazepin-8-yl)pyrrolidin-2-one
CID 154974464
1-(4-methoxyphenyl)-1,4-diazepane-2,5-dione
CID 64955856

Frequently Asked Questions

What is the IUPAC name of 4-[1-(4-methoxyphenyl)imidazol-2-yl]-7-(2-oxopyrrolidin-1-yl)-3,4-dihydro-1H-quinolin-2-one?
The IUPAC name of 4-[1-(4-methoxyphenyl)imidazol-2-yl]-7-(2-oxopyrrolidin-1-yl)-3,4-dihydro-1H-quinolin-2-one (CID 170506240) is 4-[1-(4-methoxyphenyl)imidazol-2-yl]-7-(2-oxopyrrolidin-1-yl)-3,4-dihydro-1H-quinolin-2-one.
What is the SMILES notation for 4-[1-(4-methoxyphenyl)imidazol-2-yl]-7-(2-oxopyrrolidin-1-yl)-3,4-dihydro-1H-quinolin-2-one?
The canonical SMILES for 4-[1-(4-methoxyphenyl)imidazol-2-yl]-7-(2-oxopyrrolidin-1-yl)-3,4-dihydro-1H-quinolin-2-one is COc1ccc(-n2ccnc2C2CC(=O)Nc3cc(N4CCCC4=O)ccc32)cc1.
What is the InChIKey of 4-[1-(4-methoxyphenyl)imidazol-2-yl]-7-(2-oxopyrrolidin-1-yl)-3,4-dihydro-1H-quinolin-2-one?
The InChIKey is SQOPMCZWHVPREE-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N4O3/c1-30-17-7-4-15(5-8-17)27-12-10-24-23(27)19-14-21(28)25-20-13-16(6-9-18(19)20)26-11-2-3-22(26)29/h4-10,12-13,19H,2-3,11,14H2,1H3,(H,25,28).
What are the key properties of 4-[1-(4-methoxyphenyl)imidazol-2-yl]-7-(2-oxopyrrolidin-1-yl)-3,4-dihydro-1H-quinolin-2-one?
4-[1-(4-methoxyphenyl)imidazol-2-yl]-7-(2-oxopyrrolidin-1-yl)-3,4-dihydro-1H-quinolin-2-one has a molecular weight of 402.45 g/mol, XLogP of 3.48, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(4-methoxyphenyl)imidazol-2-yl]-7-(2-oxopyrrolidin-1-yl)-3,4-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 170506240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).