[2-(methylaminomethyl)-3H-benzimidazol-5-yl]methanamine

C10H14N4 — CID 83949221

IUPAC[2-(methylaminomethyl)-3H-benzimidazol-5-yl]methanamine
SMILESCNCc1nc2ccc(CN)cc2[nH]1
InChIInChI=1S/C10H14N4/c1-12-6-10-13-8-3-2-7(5-11)4-9(8)14-10/h2-4,12H,5-6,11H2,1H3,(H,13,14)
InChIKeyVYOZXKLFHHEKTG-UHFFFAOYSA-N
MW190.25 g/mol
LogP0.74
Rot. Bonds3

About [2-(methylaminomethyl)-3H-benzimidazol-5-yl]methanamine

[2-(methylaminomethyl)-3H-benzimidazol-5-yl]methanamine (PubChem CID 83949221) has the molecular formula C10H14N4 and a molecular weight of 190.25 g/mol. Its IUPAC name is [2-(methylaminomethyl)-3H-benzimidazol-5-yl]methanamine.

Molecular Properties

Compound Name[2-(methylaminomethyl)-3H-benzimidazol-5-yl]methanamine
PubChem CID83949221
Molecular FormulaC10H14N4
Molecular Weight190.25 g/mol
Exact Mass190.12
IUPAC Name[2-(methylaminomethyl)-3H-benzimidazol-5-yl]methanamine
SMILESCNCc1nc2ccc(CN)cc2[nH]1
InChIInChI=1S/C10H14N4/c1-12-6-10-13-8-3-2-7(5-11)4-9(8)14-10/h2-4,12H,5-6,11H2,1H3,(H,13,14)
InChIKeyVYOZXKLFHHEKTG-UHFFFAOYSA-N
XLogP0.74
TPSA66.73 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 50.74
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze [2-(methylaminomethyl)-3H-benzimidazol-5-yl]methanamine 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

(2-butyl-3H-benzimidazol-5-yl)methanamine
CID 79004472
N-methyl-1-[2-(2-methylpropyl)-3H-benzimidazol-5-yl]methanamine
CID 84683142
[2-(2-methoxyethyl)-3H-benzimidazol-5-yl]methanamine
CID 79004507
[2-[(3-bromophenyl)methyl]-3H-benzimidazol-5-yl]methanamine
CID 79004444
[2-[(3-methoxyphenyl)methyl]-3H-benzimidazol-5-yl]methanamine
CID 79004539
1-(1H-benzimidazol-2-yl)-N-methylmethanamine;dihydrochloride
CID 13169407
N-methyl-1-(2-propan-2-yl-3H-benzimidazol-5-yl)methanamine
CID 82491783
7-(aminomethyl)-3-methyl-1H-quinoxalin-2-one
CID 177146036
[2-(thian-4-ylmethyl)-3H-benzimidazol-5-yl]methanamine
CID 83135372
[2-(3-methylbutan-2-yl)-3H-benzimidazol-5-yl]methanamine
CID 79004415
2-[2-[(4-fluorophenyl)methyl]-3H-benzimidazol-5-yl]ethanamine
CID 82305556
2-(chloromethyl)-6-ethyl-1H-benzimidazole
CID 14096341

Frequently Asked Questions

What is the IUPAC name of [2-(methylaminomethyl)-3H-benzimidazol-5-yl]methanamine?
The IUPAC name of [2-(methylaminomethyl)-3H-benzimidazol-5-yl]methanamine (CID 83949221) is [2-(methylaminomethyl)-3H-benzimidazol-5-yl]methanamine.
What is the SMILES notation for [2-(methylaminomethyl)-3H-benzimidazol-5-yl]methanamine?
The canonical SMILES for [2-(methylaminomethyl)-3H-benzimidazol-5-yl]methanamine is CNCc1nc2ccc(CN)cc2[nH]1.
What is the InChIKey of [2-(methylaminomethyl)-3H-benzimidazol-5-yl]methanamine?
The InChIKey is VYOZXKLFHHEKTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4/c1-12-6-10-13-8-3-2-7(5-11)4-9(8)14-10/h2-4,12H,5-6,11H2,1H3,(H,13,14).
What are the key properties of [2-(methylaminomethyl)-3H-benzimidazol-5-yl]methanamine?
[2-(methylaminomethyl)-3H-benzimidazol-5-yl]methanamine has a molecular weight of 190.25 g/mol, XLogP of 0.74, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(methylaminomethyl)-3H-benzimidazol-5-yl]methanamine is sourced from PubChem (CID 83949221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).