6-chloro-N-(5-chloro-2-methylphenyl)-1H-benzimidazol-2-amine

C14H11Cl2N3 — CID 82562664

IUPAC6-chloro-N-(5-chloro-2-methylphenyl)-1H-benzimidazol-2-amine
SMILESCc1ccc(Cl)cc1Nc1nc2ccc(Cl)cc2[nH]1
InChIInChI=1S/C14H11Cl2N3/c1-8-2-3-9(15)6-12(8)18-14-17-11-5-4-10(16)7-13(11)19-14/h2-7H,1H3,(H2,17,18,19)
InChIKeyBLEMWWKNOXUVHQ-UHFFFAOYSA-N
MW292.17 g/mol
LogP4.92
Rot. Bonds2

About 6-chloro-N-(5-chloro-2-methylphenyl)-1H-benzimidazol-2-amine

6-chloro-N-(5-chloro-2-methylphenyl)-1H-benzimidazol-2-amine (PubChem CID 82562664) has the molecular formula C14H11Cl2N3 and a molecular weight of 292.17 g/mol. Its IUPAC name is 6-chloro-N-(5-chloro-2-methylphenyl)-1H-benzimidazol-2-amine.

Molecular Properties

Compound Name6-chloro-N-(5-chloro-2-methylphenyl)-1H-benzimidazol-2-amine
PubChem CID82562664
Molecular FormulaC14H11Cl2N3
Molecular Weight292.17 g/mol
Exact Mass291.03
IUPAC Name6-chloro-N-(5-chloro-2-methylphenyl)-1H-benzimidazol-2-amine
SMILESCc1ccc(Cl)cc1Nc1nc2ccc(Cl)cc2[nH]1
InChIInChI=1S/C14H11Cl2N3/c1-8-2-3-9(15)6-12(8)18-14-17-11-5-4-10(16)7-13(11)19-14/h2-7H,1H3,(H2,17,18,19)
InChIKeyBLEMWWKNOXUVHQ-UHFFFAOYSA-N
XLogP4.92
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.17
LogP ≤ 54.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-N,4-N-bis(6-chloro-1H-benzimidazol-2-yl)benzene-1,4-diamine
CID 14688884
6-chloro-N-(3,5-dichlorophenyl)-1H-benzimidazol-2-amine;hydrochloride
CID 24970552
N-tert-butyl-6-chloro-1H-benzimidazol-2-amine
CID 119086306
N-(5-bromo-1H-pyrrolo[3,2-b]pyridin-3-yl)-6-chloro-1H-benzimidazol-2-amine
CID 156865294
2-(5-chloro-2-methylanilino)-4-ethyl-1H-pyrimidin-6-one
CID 136778628
N-[3-[(6-chloro-1H-benzimidazol-2-yl)amino]phenyl]acetamide
CID 82562667
2-(5-chloro-2-methylanilino)-4-propyl-1H-pyrimidin-6-one
CID 135459608
N-(2-methylphenyl)-1H-benzimidazol-2-amine
CID 923872
6-chloro-N-[(4-chlorophenyl)methyl]-1H-benzimidazol-2-amine
CID 82562708
N-(2-methylphenyl)-1H-benzimidazol-2-amine;hydrochloride
CID 22288832
6-chloro-N-(2-phenylethyl)-1H-benzimidazol-2-amine
CID 45021337
carbon dioxide;N-(6-chloro-1H-benzimidazol-2-yl)-1-methylbenzimidazol-2-amine
CID 176544013

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(5-chloro-2-methylphenyl)-1H-benzimidazol-2-amine?
The IUPAC name of 6-chloro-N-(5-chloro-2-methylphenyl)-1H-benzimidazol-2-amine (CID 82562664) is 6-chloro-N-(5-chloro-2-methylphenyl)-1H-benzimidazol-2-amine.
What is the SMILES notation for 6-chloro-N-(5-chloro-2-methylphenyl)-1H-benzimidazol-2-amine?
The canonical SMILES for 6-chloro-N-(5-chloro-2-methylphenyl)-1H-benzimidazol-2-amine is Cc1ccc(Cl)cc1Nc1nc2ccc(Cl)cc2[nH]1.
What is the InChIKey of 6-chloro-N-(5-chloro-2-methylphenyl)-1H-benzimidazol-2-amine?
The InChIKey is BLEMWWKNOXUVHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11Cl2N3/c1-8-2-3-9(15)6-12(8)18-14-17-11-5-4-10(16)7-13(11)19-14/h2-7H,1H3,(H2,17,18,19).
What are the key properties of 6-chloro-N-(5-chloro-2-methylphenyl)-1H-benzimidazol-2-amine?
6-chloro-N-(5-chloro-2-methylphenyl)-1H-benzimidazol-2-amine has a molecular weight of 292.17 g/mol, XLogP of 4.92, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(5-chloro-2-methylphenyl)-1H-benzimidazol-2-amine is sourced from PubChem (CID 82562664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).