1-(2-chloro-4-fluorophenyl)-3-methyl-8-pyridin-3-ylimidazo[4,5-c]quinolin-2-one

C22H14ClFN4O — CID 11978210

IUPAC1-(2-chloro-4-fluorophenyl)-3-methyl-8-pyridin-3-ylimidazo[4,5-c]quinolin-2-one
SMILESCn1c(=O)n(-c2ccc(F)cc2Cl)c2c3cc(-c4cccnc4)ccc3ncc21
InChIInChI=1S/C22H14ClFN4O/c1-27-20-12-26-18-6-4-13(14-3-2-8-25-11-14)9-16(18)21(20)28(22(27)29)19-7-5-15(24)10-17(19)23/h2-12H,1H3
InChIKeyWOVXBSCXHINAHO-UHFFFAOYSA-N
MW404.83 g/mol
LogP4.73
Rot. Bonds2

About 1-(2-chloro-4-fluorophenyl)-3-methyl-8-pyridin-3-ylimidazo[4,5-c]quinolin-2-one

1-(2-chloro-4-fluorophenyl)-3-methyl-8-pyridin-3-ylimidazo[4,5-c]quinolin-2-one (PubChem CID 11978210) has the molecular formula C22H14ClFN4O and a molecular weight of 404.83 g/mol. Its IUPAC name is 1-(2-chloro-4-fluorophenyl)-3-methyl-8-pyridin-3-ylimidazo[4,5-c]quinolin-2-one.

Molecular Properties

Compound Name1-(2-chloro-4-fluorophenyl)-3-methyl-8-pyridin-3-ylimidazo[4,5-c]quinolin-2-one
PubChem CID11978210
Molecular FormulaC22H14ClFN4O
Molecular Weight404.83 g/mol
Exact Mass404.08
IUPAC Name1-(2-chloro-4-fluorophenyl)-3-methyl-8-pyridin-3-ylimidazo[4,5-c]quinolin-2-one
SMILESCn1c(=O)n(-c2ccc(F)cc2Cl)c2c3cc(-c4cccnc4)ccc3ncc21
InChIInChI=1S/C22H14ClFN4O/c1-27-20-12-26-18-6-4-13(14-3-2-8-25-11-14)9-16(18)21(20)28(22(27)29)19-7-5-15(24)10-17(19)23/h2-12H,1H3
InChIKeyWOVXBSCXHINAHO-UHFFFAOYSA-N
XLogP4.73
TPSA52.71 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.83
LogP ≤ 54.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 1-(2-chloro-4-fluorophenyl)-3-methyl-8-pyridin-3-ylimidazo[4,5-c]quinolin-2-one with MolForge

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Related Compounds

Dactolisib
CID 11977753
6-chloro-5-methyl-N-quinolin-4-yl-2,3-dihydroindole-1-carboxamide
CID 6603999
3-Methyl-1-(oxan-4-yl)-8-pyridin-3-yl-imidazo[4,5-c]quinolin-2-one
CID 134163712
1-[4-(2-Chloro-phenyl)-6-methyl-quinolin-3-yl]-3-(2,4-difluoro-phenyl)-urea
CID 9979729
1-[4-(2-Chloro-phenyl)-6-ethyl-quinolin-3-yl]-3-(2,4-difluoro-phenyl)-urea
CID 10026104
4-(2-Chlorophenyl)-3-[3-(2,4-difluoro-phenyl)ureido]-6,8-dimethylquinoline
CID 10048726
1-[4-(2-Chloro-phenyl)-6,8-dimethyl-quinolin-3-yl]-3-(2,4,6-trifluoro-phenyl)-urea
CID 10049684
1-[4-(2-Chloro-phenyl)-6-isopropyl-quinolin-3-yl]-3-(2,4-difluoro-phenyl)-urea
CID 10253303
1-[8-Chloro-4-(2-chloro-phenyl)-6-methyl-quinolin-3-yl]-3-(2,4-difluoro-phenyl)-urea
CID 10389420
Nvp-bbd130
CID 11751126
2-Methyl-2-[4-(3-methyl-2-oxo-8-pyridin-4-yl-2,3-dihydro-imidazo[4,5-c]quinolin-1-yl)-phenyl]-propionitrile
CID 11957743
4-[2,3-Dihydro-3-methyl-2-oxo-8-(3-pyridinyl)-1H-imidazo[4,5-c]quinolin-1-yl]-I+/-,I+/--dimethylbenzeneacetonitrile
CID 11977649

Frequently Asked Questions

What is the IUPAC name of 1-(2-chloro-4-fluorophenyl)-3-methyl-8-pyridin-3-ylimidazo[4,5-c]quinolin-2-one?
The IUPAC name of 1-(2-chloro-4-fluorophenyl)-3-methyl-8-pyridin-3-ylimidazo[4,5-c]quinolin-2-one (CID 11978210) is 1-(2-chloro-4-fluorophenyl)-3-methyl-8-pyridin-3-ylimidazo[4,5-c]quinolin-2-one.
What is the SMILES notation for 1-(2-chloro-4-fluorophenyl)-3-methyl-8-pyridin-3-ylimidazo[4,5-c]quinolin-2-one?
The canonical SMILES for 1-(2-chloro-4-fluorophenyl)-3-methyl-8-pyridin-3-ylimidazo[4,5-c]quinolin-2-one is Cn1c(=O)n(-c2ccc(F)cc2Cl)c2c3cc(-c4cccnc4)ccc3ncc21.
What is the InChIKey of 1-(2-chloro-4-fluorophenyl)-3-methyl-8-pyridin-3-ylimidazo[4,5-c]quinolin-2-one?
The InChIKey is WOVXBSCXHINAHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H14ClFN4O/c1-27-20-12-26-18-6-4-13(14-3-2-8-25-11-14)9-16(18)21(20)28(22(27)29)19-7-5-15(24)10-17(19)23/h2-12H,1H3.
What are the key properties of 1-(2-chloro-4-fluorophenyl)-3-methyl-8-pyridin-3-ylimidazo[4,5-c]quinolin-2-one?
1-(2-chloro-4-fluorophenyl)-3-methyl-8-pyridin-3-ylimidazo[4,5-c]quinolin-2-one has a molecular weight of 404.83 g/mol, XLogP of 4.73, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chloro-4-fluorophenyl)-3-methyl-8-pyridin-3-ylimidazo[4,5-c]quinolin-2-one is sourced from PubChem (CID 11978210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).