4-chloro-1-(2-chloro-6-methylphenyl)benzimidazol-2-amine

C14H11Cl2N3 — CID 104837184

IUPAC4-chloro-1-(2-chloro-6-methylphenyl)benzimidazol-2-amine
SMILESCc1cccc(Cl)c1-n1c(N)nc2c(Cl)cccc21
InChIInChI=1S/C14H11Cl2N3/c1-8-4-2-6-10(16)13(8)19-11-7-3-5-9(15)12(11)18-14(19)17/h2-7H,1H3,(H2,17,18)
InChIKeyWXVAVUNIAPJODJ-UHFFFAOYSA-N
MW292.17 g/mol
LogP4.22
Rot. Bonds1

About 4-chloro-1-(2-chloro-6-methylphenyl)benzimidazol-2-amine

4-chloro-1-(2-chloro-6-methylphenyl)benzimidazol-2-amine (PubChem CID 104837184) has the molecular formula C14H11Cl2N3 and a molecular weight of 292.17 g/mol. Its IUPAC name is 4-chloro-1-(2-chloro-6-methylphenyl)benzimidazol-2-amine.

Molecular Properties

Compound Name4-chloro-1-(2-chloro-6-methylphenyl)benzimidazol-2-amine
PubChem CID104837184
Molecular FormulaC14H11Cl2N3
Molecular Weight292.17 g/mol
Exact Mass291.03
IUPAC Name4-chloro-1-(2-chloro-6-methylphenyl)benzimidazol-2-amine
SMILESCc1cccc(Cl)c1-n1c(N)nc2c(Cl)cccc21
InChIInChI=1S/C14H11Cl2N3/c1-8-4-2-6-10(16)13(8)19-11-7-3-5-9(15)12(11)18-14(19)17/h2-7H,1H3,(H2,17,18)
InChIKeyWXVAVUNIAPJODJ-UHFFFAOYSA-N
XLogP4.22
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.17
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-1-(2-chloro-6-methylphenyl)benzimidazole-4-carbonitrile
CID 104719050
4-chloro-1-(2,6-difluoro-3-methylphenyl)benzimidazol-2-amine
CID 104837243
4-chloro-1-(3-methylphenyl)benzimidazol-2-amine
CID 104836856
4-chloro-1-(2,4-dichlorophenyl)benzimidazol-2-amine
CID 104836871
1-(4-bromophenyl)-4-chlorobenzimidazol-2-amine
CID 113459008
4-chloro-1-(2,5-dichlorophenyl)benzimidazol-2-amine
CID 104836825
4-chloro-1-(3-fluorophenyl)benzimidazol-2-amine
CID 104836818
4-chloro-1-[2-(2-methylphenyl)ethyl]benzimidazol-2-amine
CID 104837197
4-chloro-1-(4-methylsulfonylphenyl)benzimidazol-2-amine
CID 104836835
4-chloro-1-(3-chloro-4-methoxyphenyl)benzimidazol-2-amine
CID 104836895
2-(chloromethyl)-1-(2-chloro-6-methylphenyl)-4-fluorobenzimidazole
CID 66251217
2-(chloromethyl)-1-(2-chloro-6-methylphenyl)benzimidazole
CID 66253533

Frequently Asked Questions

What is the IUPAC name of 4-chloro-1-(2-chloro-6-methylphenyl)benzimidazol-2-amine?
The IUPAC name of 4-chloro-1-(2-chloro-6-methylphenyl)benzimidazol-2-amine (CID 104837184) is 4-chloro-1-(2-chloro-6-methylphenyl)benzimidazol-2-amine.
What is the SMILES notation for 4-chloro-1-(2-chloro-6-methylphenyl)benzimidazol-2-amine?
The canonical SMILES for 4-chloro-1-(2-chloro-6-methylphenyl)benzimidazol-2-amine is Cc1cccc(Cl)c1-n1c(N)nc2c(Cl)cccc21.
What is the InChIKey of 4-chloro-1-(2-chloro-6-methylphenyl)benzimidazol-2-amine?
The InChIKey is WXVAVUNIAPJODJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11Cl2N3/c1-8-4-2-6-10(16)13(8)19-11-7-3-5-9(15)12(11)18-14(19)17/h2-7H,1H3,(H2,17,18).
What are the key properties of 4-chloro-1-(2-chloro-6-methylphenyl)benzimidazol-2-amine?
4-chloro-1-(2-chloro-6-methylphenyl)benzimidazol-2-amine has a molecular weight of 292.17 g/mol, XLogP of 4.22, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-1-(2-chloro-6-methylphenyl)benzimidazol-2-amine is sourced from PubChem (CID 104837184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).