N-methyl-N-(pyridin-3-ylmethyl)-1H-benzimidazol-2-amine

C14H14N4 — CID 115143872

IUPACN-methyl-N-(pyridin-3-ylmethyl)-1H-benzimidazol-2-amine
SMILESCN(Cc1cccnc1)c1nc2ccccc2[nH]1
InChIInChI=1S/C14H14N4/c1-18(10-11-5-4-8-15-9-11)14-16-12-6-2-3-7-13(12)17-14/h2-9H,10H2,1H3,(H,16,17)
InChIKeyZNDYHHBFSGBZGF-UHFFFAOYSA-N
MW238.29 g/mol
LogP2.59
Rot. Bonds3

About N-methyl-N-(pyridin-3-ylmethyl)-1H-benzimidazol-2-amine

N-methyl-N-(pyridin-3-ylmethyl)-1H-benzimidazol-2-amine (PubChem CID 115143872) has the molecular formula C14H14N4 and a molecular weight of 238.29 g/mol. Its IUPAC name is N-methyl-N-(pyridin-3-ylmethyl)-1H-benzimidazol-2-amine.

Molecular Properties

Compound NameN-methyl-N-(pyridin-3-ylmethyl)-1H-benzimidazol-2-amine
PubChem CID115143872
Molecular FormulaC14H14N4
Molecular Weight238.29 g/mol
Exact Mass238.12
IUPAC NameN-methyl-N-(pyridin-3-ylmethyl)-1H-benzimidazol-2-amine
SMILESCN(Cc1cccnc1)c1nc2ccccc2[nH]1
InChIInChI=1S/C14H14N4/c1-18(10-11-5-4-8-15-9-11)14-16-12-6-2-3-7-13(12)17-14/h2-9H,10H2,1H3,(H,16,17)
InChIKeyZNDYHHBFSGBZGF-UHFFFAOYSA-N
XLogP2.59
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-methyl-N-(pyridin-3-ylmethyl)-1H-benzimidazol-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N,N-dimethyl-1H-benzimidazol-2-amine
CID 17846
N-butyl-N-methyl-1H-benzimidazol-2-amine
CID 71723451
N-(1H-benzimidazol-2-ylmethyl)-N-[(2-methoxyphenyl)methyl]-1-pyridin-3-ylmethanamine
CID 46983929
2-(pyridin-3-ylmethylsulfanyl)-1H-benzimidazole
CID 3012526
N-(2-chloropropyl)-N-methyl-1H-benzimidazol-2-amine
CID 63392162
N-(2-methoxyethyl)-N-methyl-1H-benzimidazol-2-amine
CID 133409792
2-(1H-benzimidazol-2-yl)-3-pyridin-3-ylpropan-1-amine
CID 83976034
[2-[methyl(pyridin-3-ylmethyl)amino]quinolin-4-yl]methanol
CID 61255834
7-(1H-indol-3-ylmethyl)-2-[methyl(pyridin-3-ylmethyl)amino]-5,6,8,9-tetrahydro-3H-pyrimido[4,5-d]azepin-4-one
CID 136880729
N-methyl-N-propan-2-yl-1H-benzimidazol-2-amine
CID 90287555
5-iodo-N,2-dimethyl-N-(pyridin-3-ylmethyl)pyrimidin-4-amine
CID 154785251
6-chloro-2-N,4-N,4-N-trimethyl-2-N-(pyridin-3-ylmethyl)-1,3,5-triazine-2,4-diamine
CID 55125410

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(pyridin-3-ylmethyl)-1H-benzimidazol-2-amine?
The IUPAC name of N-methyl-N-(pyridin-3-ylmethyl)-1H-benzimidazol-2-amine (CID 115143872) is N-methyl-N-(pyridin-3-ylmethyl)-1H-benzimidazol-2-amine.
What is the SMILES notation for N-methyl-N-(pyridin-3-ylmethyl)-1H-benzimidazol-2-amine?
The canonical SMILES for N-methyl-N-(pyridin-3-ylmethyl)-1H-benzimidazol-2-amine is CN(Cc1cccnc1)c1nc2ccccc2[nH]1.
What is the InChIKey of N-methyl-N-(pyridin-3-ylmethyl)-1H-benzimidazol-2-amine?
The InChIKey is ZNDYHHBFSGBZGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4/c1-18(10-11-5-4-8-15-9-11)14-16-12-6-2-3-7-13(12)17-14/h2-9H,10H2,1H3,(H,16,17).
What are the key properties of N-methyl-N-(pyridin-3-ylmethyl)-1H-benzimidazol-2-amine?
N-methyl-N-(pyridin-3-ylmethyl)-1H-benzimidazol-2-amine has a molecular weight of 238.29 g/mol, XLogP of 2.59, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(pyridin-3-ylmethyl)-1H-benzimidazol-2-amine is sourced from PubChem (CID 115143872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).