2-(4,6-dimethyl-1H-benzimidazol-2-yl)pyridin-3-amine

C14H14N4 — CID 104740767

IUPAC2-(4,6-dimethyl-1H-benzimidazol-2-yl)pyridin-3-amine
SMILESCc1cc(C)c2nc(-c3ncccc3N)[nH]c2c1
InChIInChI=1S/C14H14N4/c1-8-6-9(2)12-11(7-8)17-14(18-12)13-10(15)4-3-5-16-13/h3-7H,15H2,1-2H3,(H,17,18)
InChIKeyADHVWZKBGXPUGQ-UHFFFAOYSA-N
MW238.29 g/mol
LogP2.82
Rot. Bonds1

About 2-(4,6-dimethyl-1H-benzimidazol-2-yl)pyridin-3-amine

2-(4,6-dimethyl-1H-benzimidazol-2-yl)pyridin-3-amine (PubChem CID 104740767) has the molecular formula C14H14N4 and a molecular weight of 238.29 g/mol. Its IUPAC name is 2-(4,6-dimethyl-1H-benzimidazol-2-yl)pyridin-3-amine.

Molecular Properties

Compound Name2-(4,6-dimethyl-1H-benzimidazol-2-yl)pyridin-3-amine
PubChem CID104740767
Molecular FormulaC14H14N4
Molecular Weight238.29 g/mol
Exact Mass238.12
IUPAC Name2-(4,6-dimethyl-1H-benzimidazol-2-yl)pyridin-3-amine
SMILESCc1cc(C)c2nc(-c3ncccc3N)[nH]c2c1
InChIInChI=1S/C14H14N4/c1-8-6-9(2)12-11(7-8)17-14(18-12)13-10(15)4-3-5-16-13/h3-7H,15H2,1-2H3,(H,17,18)
InChIKeyADHVWZKBGXPUGQ-UHFFFAOYSA-N
XLogP2.82
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 52.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-chloro-2-(4,6-dimethyl-1H-benzimidazol-2-yl)aniline
CID 82946597
6-bromo-4-methyl-2-(3-methyl-2-pyridinyl)-1H-benzimidazole
CID 113428441
4-(4,6-dimethyl-1H-benzimidazol-2-yl)pyridin-2-amine
CID 82946945
4-(4,6-dimethyl-1H-benzimidazol-2-yl)pyridin-3-amine
CID 82947385
6-(4,6-dimethyl-1H-benzimidazol-2-yl)pyridin-3-amine
CID 82946936
4-bromo-2-(4,6-dimethyl-1H-benzimidazol-2-yl)aniline
CID 82947294
2-(4-methylsulfonyl-1H-benzimidazol-2-yl)pyridin-3-amine
CID 104740764
2-(3,4-dichlorophenyl)-4,6-dimethyl-1H-benzimidazole
CID 56773183
2-(3-amino-2-pyridinyl)-3H-benzimidazol-5-ol
CID 137016825
2-(4-fluorophenyl)-4,6-dimethyl-1H-benzimidazole
CID 56773179
4,6-dimethyl-2-(5-methylthiophen-2-yl)-1H-benzimidazole
CID 82947476
3-(4,6-dimethyl-1H-benzimidazol-2-yl)-5-methylthiophen-2-amine
CID 82946515

Frequently Asked Questions

What is the IUPAC name of 2-(4,6-dimethyl-1H-benzimidazol-2-yl)pyridin-3-amine?
The IUPAC name of 2-(4,6-dimethyl-1H-benzimidazol-2-yl)pyridin-3-amine (CID 104740767) is 2-(4,6-dimethyl-1H-benzimidazol-2-yl)pyridin-3-amine.
What is the SMILES notation for 2-(4,6-dimethyl-1H-benzimidazol-2-yl)pyridin-3-amine?
The canonical SMILES for 2-(4,6-dimethyl-1H-benzimidazol-2-yl)pyridin-3-amine is Cc1cc(C)c2nc(-c3ncccc3N)[nH]c2c1.
What is the InChIKey of 2-(4,6-dimethyl-1H-benzimidazol-2-yl)pyridin-3-amine?
The InChIKey is ADHVWZKBGXPUGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4/c1-8-6-9(2)12-11(7-8)17-14(18-12)13-10(15)4-3-5-16-13/h3-7H,15H2,1-2H3,(H,17,18).
What are the key properties of 2-(4,6-dimethyl-1H-benzimidazol-2-yl)pyridin-3-amine?
2-(4,6-dimethyl-1H-benzimidazol-2-yl)pyridin-3-amine has a molecular weight of 238.29 g/mol, XLogP of 2.82, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,6-dimethyl-1H-benzimidazol-2-yl)pyridin-3-amine is sourced from PubChem (CID 104740767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).