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

C14H14N4 — CID 82946945

IUPAC4-(4,6-dimethyl-1H-benzimidazol-2-yl)pyridin-2-amine
SMILESCc1cc(C)c2nc(-c3ccnc(N)c3)[nH]c2c1
InChIInChI=1S/C14H14N4/c1-8-5-9(2)13-11(6-8)17-14(18-13)10-3-4-16-12(15)7-10/h3-7H,1-2H3,(H2,15,16)(H,17,18)
InChIKeyPXFKVLIMUDMAQO-UHFFFAOYSA-N
MW238.29 g/mol
LogP2.82
Rot. Bonds1

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

4-(4,6-dimethyl-1H-benzimidazol-2-yl)pyridin-2-amine (PubChem CID 82946945) has the molecular formula C14H14N4 and a molecular weight of 238.29 g/mol. Its IUPAC name is 4-(4,6-dimethyl-1H-benzimidazol-2-yl)pyridin-2-amine.

Molecular Properties

Compound Name4-(4,6-dimethyl-1H-benzimidazol-2-yl)pyridin-2-amine
PubChem CID82946945
Molecular FormulaC14H14N4
Molecular Weight238.29 g/mol
Exact Mass238.12
IUPAC Name4-(4,6-dimethyl-1H-benzimidazol-2-yl)pyridin-2-amine
SMILESCc1cc(C)c2nc(-c3ccnc(N)c3)[nH]c2c1
InChIInChI=1S/C14H14N4/c1-8-5-9(2)13-11(6-8)17-14(18-13)10-3-4-16-12(15)7-10/h3-7H,1-2H3,(H2,15,16)(H,17,18)
InChIKeyPXFKVLIMUDMAQO-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

2-(3,4-dichlorophenyl)-4,6-dimethyl-1H-benzimidazole
CID 56773183
4-(4,6-dimethyl-1H-benzimidazol-2-yl)pyridin-3-amine
CID 82947385
2-(4-fluorophenyl)-4,6-dimethyl-1H-benzimidazole
CID 56773179
5-(4,6-dimethyl-1H-benzimidazol-2-yl)pyridin-3-amine
CID 82947728
2-(4,6-dimethyl-1H-benzimidazol-2-yl)pyridin-3-amine
CID 104740767
6-(4,6-dimethyl-1H-benzimidazol-2-yl)pyridin-3-amine
CID 82946936
3-bromo-5-(4,6-dimethyl-1H-benzimidazol-2-yl)aniline
CID 82947637
4,6-dimethyl-2-(5-methyl-3-pyridinyl)-1H-benzimidazole
CID 82946962
4,6-dimethyl-2-(5-methylthiophen-2-yl)-1H-benzimidazole
CID 82947476
4,6-dimethyl-2-(4-propan-2-ylphenyl)-1H-benzimidazole
CID 56773162
2-[4-(chloromethyl)phenyl]-4,6-dimethyl-1H-benzimidazole
CID 82946949
2-(3,5-dimethoxyphenyl)-4,6-dimethyl-1H-benzimidazole
CID 82942404

Frequently Asked Questions

What is the IUPAC name of 4-(4,6-dimethyl-1H-benzimidazol-2-yl)pyridin-2-amine?
The IUPAC name of 4-(4,6-dimethyl-1H-benzimidazol-2-yl)pyridin-2-amine (CID 82946945) is 4-(4,6-dimethyl-1H-benzimidazol-2-yl)pyridin-2-amine.
What is the SMILES notation for 4-(4,6-dimethyl-1H-benzimidazol-2-yl)pyridin-2-amine?
The canonical SMILES for 4-(4,6-dimethyl-1H-benzimidazol-2-yl)pyridin-2-amine is Cc1cc(C)c2nc(-c3ccnc(N)c3)[nH]c2c1.
What is the InChIKey of 4-(4,6-dimethyl-1H-benzimidazol-2-yl)pyridin-2-amine?
The InChIKey is PXFKVLIMUDMAQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4/c1-8-5-9(2)13-11(6-8)17-14(18-13)10-3-4-16-12(15)7-10/h3-7H,1-2H3,(H2,15,16)(H,17,18).
What are the key properties of 4-(4,6-dimethyl-1H-benzimidazol-2-yl)pyridin-2-amine?
4-(4,6-dimethyl-1H-benzimidazol-2-yl)pyridin-2-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 4-(4,6-dimethyl-1H-benzimidazol-2-yl)pyridin-2-amine is sourced from PubChem (CID 82946945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).