1-(2-ethyl-1H-benzimidazol-4-yl)-N-methylmethanamine

C11H15N3 — CID 83877191

IUPAC1-(2-ethyl-1H-benzimidazol-4-yl)-N-methylmethanamine
SMILESCCc1nc2c(CNC)cccc2[nH]1
InChIInChI=1S/C11H15N3/c1-3-10-13-9-6-4-5-8(7-12-2)11(9)14-10/h4-6,12H,3,7H2,1-2H3,(H,13,14)
InChIKeyRPXGGBRZVZBVAD-UHFFFAOYSA-N
MW189.26 g/mol
LogP1.84
Rot. Bonds3

About 1-(2-ethyl-1H-benzimidazol-4-yl)-N-methylmethanamine

1-(2-ethyl-1H-benzimidazol-4-yl)-N-methylmethanamine (PubChem CID 83877191) has the molecular formula C11H15N3 and a molecular weight of 189.26 g/mol. Its IUPAC name is 1-(2-ethyl-1H-benzimidazol-4-yl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(2-ethyl-1H-benzimidazol-4-yl)-N-methylmethanamine
PubChem CID83877191
Molecular FormulaC11H15N3
Molecular Weight189.26 g/mol
Exact Mass189.13
IUPAC Name1-(2-ethyl-1H-benzimidazol-4-yl)-N-methylmethanamine
SMILESCCc1nc2c(CNC)cccc2[nH]1
InChIInChI=1S/C11H15N3/c1-3-10-13-9-6-4-5-8(7-12-2)11(9)14-10/h4-6,12H,3,7H2,1-2H3,(H,13,14)
InChIKeyRPXGGBRZVZBVAD-UHFFFAOYSA-N
XLogP1.84
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.26
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 1-(2-ethyl-1H-benzimidazol-4-yl)-N-methylmethanamine 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

1-(2-ethyl-1H-benzimidazol-4-yl)propan-2-one
CID 83881168
2-(4-ethyl-1H-benzimidazol-2-yl)acetonitrile
CID 84618582
2-[(2-fluorophenyl)methyl]-4-methyl-1H-benzimidazole
CID 60973900
2-ethyl-N'-hydroxy-1H-benzimidazole-4-carboximidamide
CID 90229020
N-methyl-2-(4-methyl-1H-benzimidazol-2-yl)ethanamine
CID 26722492
N,N-dimethyl-1-[[2-(methylaminomethyl)-1H-benzimidazol-4-yl]methyl]pyrrolidine-2-carboxamide
CID 142232803
methyl N-(4-ethyl-1H-benzimidazol-2-yl)carbamate
CID 69017528
[2-(propoxymethyl)-1H-benzimidazol-4-yl]methanamine
CID 107941841
[2-(methylsulfanylmethyl)-1H-benzimidazol-4-yl]methanamine
CID 104721264
1-(4,5-dimethyl-1H-benzimidazol-2-yl)-N-methylmethanamine
CID 84618784
bis(2-ethyl-1H-benzimidazole);sulfane
CID 68768079
1-(1H-benzimidazol-2-yl)-N-methylmethanamine;dihydrochloride
CID 13169407

Frequently Asked Questions

What is the IUPAC name of 1-(2-ethyl-1H-benzimidazol-4-yl)-N-methylmethanamine?
The IUPAC name of 1-(2-ethyl-1H-benzimidazol-4-yl)-N-methylmethanamine (CID 83877191) is 1-(2-ethyl-1H-benzimidazol-4-yl)-N-methylmethanamine.
What is the SMILES notation for 1-(2-ethyl-1H-benzimidazol-4-yl)-N-methylmethanamine?
The canonical SMILES for 1-(2-ethyl-1H-benzimidazol-4-yl)-N-methylmethanamine is CCc1nc2c(CNC)cccc2[nH]1.
What is the InChIKey of 1-(2-ethyl-1H-benzimidazol-4-yl)-N-methylmethanamine?
The InChIKey is RPXGGBRZVZBVAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3/c1-3-10-13-9-6-4-5-8(7-12-2)11(9)14-10/h4-6,12H,3,7H2,1-2H3,(H,13,14).
What are the key properties of 1-(2-ethyl-1H-benzimidazol-4-yl)-N-methylmethanamine?
1-(2-ethyl-1H-benzimidazol-4-yl)-N-methylmethanamine has a molecular weight of 189.26 g/mol, XLogP of 1.84, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethyl-1H-benzimidazol-4-yl)-N-methylmethanamine is sourced from PubChem (CID 83877191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).