6-(3-chlorophenyl)-2-(3-fluorophenyl)-1-methylimidazo[4,5-c]pyridine

C19H13ClFN3 — CID 155561809

IUPAC6-(3-chlorophenyl)-2-(3-fluorophenyl)-1-methylimidazo[4,5-c]pyridine
SMILESCn1c(-c2cccc(F)c2)nc2cnc(-c3cccc(Cl)c3)cc21
InChIInChI=1S/C19H13ClFN3/c1-24-18-10-16(12-4-2-6-14(20)8-12)22-11-17(18)23-19(24)13-5-3-7-15(21)9-13/h2-11H,1H3
InChIKeyMDSIGMCLLSSIIQ-UHFFFAOYSA-N
MW337.79 g/mol
LogP5.09
Rot. Bonds2

About 6-(3-chlorophenyl)-2-(3-fluorophenyl)-1-methylimidazo[4,5-c]pyridine

6-(3-chlorophenyl)-2-(3-fluorophenyl)-1-methylimidazo[4,5-c]pyridine (PubChem CID 155561809) has the molecular formula C19H13ClFN3 and a molecular weight of 337.79 g/mol. Its IUPAC name is 6-(3-chlorophenyl)-2-(3-fluorophenyl)-1-methylimidazo[4,5-c]pyridine.

Molecular Properties

Compound Name6-(3-chlorophenyl)-2-(3-fluorophenyl)-1-methylimidazo[4,5-c]pyridine
PubChem CID155561809
Molecular FormulaC19H13ClFN3
Molecular Weight337.79 g/mol
Exact Mass337.08
IUPAC Name6-(3-chlorophenyl)-2-(3-fluorophenyl)-1-methylimidazo[4,5-c]pyridine
SMILESCn1c(-c2cccc(F)c2)nc2cnc(-c3cccc(Cl)c3)cc21
InChIInChI=1S/C19H13ClFN3/c1-24-18-10-16(12-4-2-6-14(20)8-12)22-11-17(18)23-19(24)13-5-3-7-15(21)9-13/h2-11H,1H3
InChIKeyMDSIGMCLLSSIIQ-UHFFFAOYSA-N
XLogP5.09
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500337.79
LogP ≤ 55.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5-chloro-2-(3-fluorophenyl)-1-methylbenzimidazole
CID 47272714
[2-(3-chlorophenyl)-3-methylbenzimidazol-5-yl]methanamine
CID 104713110
2-(3-fluorophenyl)-1-methylbenzimidazole-5-carbonitrile
CID 65034830
6-chloro-1-methyl-2-phenylbenzimidazole
CID 12738431
2-[5,6-dichloro-2-(3-fluorophenyl)benzimidazol-1-yl]ethanol
CID 82149458
ethane;2-(3-fluorophenyl)-5-methylpyridine
CID 142255933
[5-(3-chlorophenyl)-1,2,4-oxadiazol-3-yl]-[5-(3-fluorophenyl)-4-methyl-1,2,4-triazol-3-yl]methanethiol
CID 87258084
2-(3-chlorophenyl)-3,5,6-trimethylpyrimidin-4-one
CID 123522555
5-chloro-1-methyl-2-pyridin-3-ylbenzimidazole
CID 10966745
2-chloro-5-(3-chlorophenyl)-1-methylimidazole
CID 117259913
2-(3-chlorophenyl)-6-(4-fluorophenyl)-7-methylimidazo[1,2-a]imidazole
CID 4693345
5-chloro-2-(3-fluorophenyl)quinoxaline
CID 151894475

Frequently Asked Questions

What is the IUPAC name of 6-(3-chlorophenyl)-2-(3-fluorophenyl)-1-methylimidazo[4,5-c]pyridine?
The IUPAC name of 6-(3-chlorophenyl)-2-(3-fluorophenyl)-1-methylimidazo[4,5-c]pyridine (CID 155561809) is 6-(3-chlorophenyl)-2-(3-fluorophenyl)-1-methylimidazo[4,5-c]pyridine.
What is the SMILES notation for 6-(3-chlorophenyl)-2-(3-fluorophenyl)-1-methylimidazo[4,5-c]pyridine?
The canonical SMILES for 6-(3-chlorophenyl)-2-(3-fluorophenyl)-1-methylimidazo[4,5-c]pyridine is Cn1c(-c2cccc(F)c2)nc2cnc(-c3cccc(Cl)c3)cc21.
What is the InChIKey of 6-(3-chlorophenyl)-2-(3-fluorophenyl)-1-methylimidazo[4,5-c]pyridine?
The InChIKey is MDSIGMCLLSSIIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13ClFN3/c1-24-18-10-16(12-4-2-6-14(20)8-12)22-11-17(18)23-19(24)13-5-3-7-15(21)9-13/h2-11H,1H3.
What are the key properties of 6-(3-chlorophenyl)-2-(3-fluorophenyl)-1-methylimidazo[4,5-c]pyridine?
6-(3-chlorophenyl)-2-(3-fluorophenyl)-1-methylimidazo[4,5-c]pyridine has a molecular weight of 337.79 g/mol, XLogP of 5.09, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-chlorophenyl)-2-(3-fluorophenyl)-1-methylimidazo[4,5-c]pyridine is sourced from PubChem (CID 155561809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).