4-chloro-2,5-diphenylimidazole-1-carbonitrile

C16H10ClN3 — CID 14641991

IUPAC4-chloro-2,5-diphenylimidazole-1-carbonitrile
SMILESN#Cn1c(-c2ccccc2)nc(Cl)c1-c1ccccc1
InChIInChI=1S/C16H10ClN3/c17-15-14(12-7-3-1-4-8-12)20(11-18)16(19-15)13-9-5-2-6-10-13/h1-10H
InChIKeyQXCXSOHEMRRAGE-UHFFFAOYSA-N
MW279.73 g/mol
LogP4.20
Rot. Bonds2

About 4-chloro-2,5-diphenylimidazole-1-carbonitrile

4-chloro-2,5-diphenylimidazole-1-carbonitrile (PubChem CID 14641991) has the molecular formula C16H10ClN3 and a molecular weight of 279.73 g/mol. Its IUPAC name is 4-chloro-2,5-diphenylimidazole-1-carbonitrile.

Molecular Properties

Compound Name4-chloro-2,5-diphenylimidazole-1-carbonitrile
PubChem CID14641991
Molecular FormulaC16H10ClN3
Molecular Weight279.73 g/mol
Exact Mass279.06
IUPAC Name4-chloro-2,5-diphenylimidazole-1-carbonitrile
SMILESN#Cn1c(-c2ccccc2)nc(Cl)c1-c1ccccc1
InChIInChI=1S/C16H10ClN3/c17-15-14(12-7-3-1-4-8-12)20(11-18)16(19-15)13-9-5-2-6-10-13/h1-10H
InChIKeyQXCXSOHEMRRAGE-UHFFFAOYSA-N
XLogP4.20
TPSA41.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.73
LogP ≤ 54.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

Cyazofamid
CID 9862076
4-Chloro-5-(4-methylphenyl)-1H-imidazole-2-carbonitrile
CID 10910992
2-(4-Chlorophenyl)-4,5-diphenylimidazole
CID 794727
1-(4-Chlorobenzyl)-5-phenyl-1H-imidazole
CID 45103809
Lepidiline B
CID 9862174
1H-Imidazole, 2-(2-chlorophenyl)-4,5-diphenyl-
CID 74356
1-Methyl-4,5-diphenyl-1H-imidazole
CID 12974798
1H-Imidazole, 2-(2-chlorophenyl)-1-[2-(2-chlorophenyl)-4,5-diphenyl-2H-imidazol-2-yl]-4,5-diphenyl-
CID 81610
4-Chloro-1-(4-chlorophenyl)-5-phenylimidazole
CID 137659804
4-(4-chlorophenyl)-5-(4-methylphenyl)-1H-imidazol-2-amine
CID 44233728
1H-Imidazole, 2,4,5-triphenyl-1-(phenylmethyl)-
CID 3615012
1-Methyl-3-(2-methylprop-2-enyl)-4,5-diphenylimidazol-1-ium
CID 2345786

Frequently Asked Questions

What is the IUPAC name of 4-chloro-2,5-diphenylimidazole-1-carbonitrile?
The IUPAC name of 4-chloro-2,5-diphenylimidazole-1-carbonitrile (CID 14641991) is 4-chloro-2,5-diphenylimidazole-1-carbonitrile.
What is the SMILES notation for 4-chloro-2,5-diphenylimidazole-1-carbonitrile?
The canonical SMILES for 4-chloro-2,5-diphenylimidazole-1-carbonitrile is N#Cn1c(-c2ccccc2)nc(Cl)c1-c1ccccc1.
What is the InChIKey of 4-chloro-2,5-diphenylimidazole-1-carbonitrile?
The InChIKey is QXCXSOHEMRRAGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10ClN3/c17-15-14(12-7-3-1-4-8-12)20(11-18)16(19-15)13-9-5-2-6-10-13/h1-10H.
What are the key properties of 4-chloro-2,5-diphenylimidazole-1-carbonitrile?
4-chloro-2,5-diphenylimidazole-1-carbonitrile has a molecular weight of 279.73 g/mol, XLogP of 4.20, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2,5-diphenylimidazole-1-carbonitrile is sourced from PubChem (CID 14641991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).