[2-(furan-2-yl)-1H-benzimidazol-4-yl]methanamine

C12H11N3O — CID 104721099

IUPAC[2-(furan-2-yl)-1H-benzimidazol-4-yl]methanamine
SMILESNCc1cccc2[nH]c(-c3ccco3)nc12
InChIInChI=1S/C12H11N3O/c13-7-8-3-1-4-9-11(8)15-12(14-9)10-5-2-6-16-10/h1-6H,7,13H2,(H,14,15)
InChIKeyNUFZSHWBUWVOAD-UHFFFAOYSA-N
MW213.24 g/mol
LogP2.28
Rot. Bonds2

About [2-(furan-2-yl)-1H-benzimidazol-4-yl]methanamine

[2-(furan-2-yl)-1H-benzimidazol-4-yl]methanamine (PubChem CID 104721099) has the molecular formula C12H11N3O and a molecular weight of 213.24 g/mol. Its IUPAC name is [2-(furan-2-yl)-1H-benzimidazol-4-yl]methanamine.

Molecular Properties

Compound Name[2-(furan-2-yl)-1H-benzimidazol-4-yl]methanamine
PubChem CID104721099
Molecular FormulaC12H11N3O
Molecular Weight213.24 g/mol
Exact Mass213.09
IUPAC Name[2-(furan-2-yl)-1H-benzimidazol-4-yl]methanamine
SMILESNCc1cccc2[nH]c(-c3ccco3)nc12
InChIInChI=1S/C12H11N3O/c13-7-8-3-1-4-9-11(8)15-12(14-9)10-5-2-6-16-10/h1-6H,7,13H2,(H,14,15)
InChIKeyNUFZSHWBUWVOAD-UHFFFAOYSA-N
XLogP2.28
TPSA67.84 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.24
LogP ≤ 52.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze [2-(furan-2-yl)-1H-benzimidazol-4-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-(5-methylfuran-2-yl)-1H-benzimidazol-4-yl]methanamine
CID 104721322
[2-(2,6-difluorophenyl)-1H-benzimidazol-4-yl]methanamine
CID 104721233
[2-(3,5-difluorophenyl)-1H-benzimidazol-4-yl]methanamine
CID 104721059
(2-isoquinolin-1-yl-1H-benzimidazol-4-yl)methanamine
CID 104721160
[2-(3-methylphenyl)-1H-benzimidazol-4-yl]methanamine
CID 104721321
2-(furan-2-yl)-3H-imidazo[4,5-f]quinoxaline
CID 13428669
[2-(2,3,4-trifluorophenyl)-1H-benzimidazol-4-yl]methanamine
CID 104721024
[2-(4-methylsulfanylphenyl)-1H-benzimidazol-4-yl]methanamine
CID 104721162
[2-(5-chlorothiophen-2-yl)-1H-benzimidazol-4-yl]methanamine
CID 104721055
2-(furan-2-yl)-1H-benzimidazole;hydrochloride
CID 163330035
[2-(4-chloro-3-fluorophenyl)-1H-benzimidazol-4-yl]methanamine
CID 107994630
[2-(2,3-dihydro-1-benzofuran-5-yl)-1H-benzimidazol-4-yl]methanamine
CID 104721133

Frequently Asked Questions

What is the IUPAC name of [2-(furan-2-yl)-1H-benzimidazol-4-yl]methanamine?
The IUPAC name of [2-(furan-2-yl)-1H-benzimidazol-4-yl]methanamine (CID 104721099) is [2-(furan-2-yl)-1H-benzimidazol-4-yl]methanamine.
What is the SMILES notation for [2-(furan-2-yl)-1H-benzimidazol-4-yl]methanamine?
The canonical SMILES for [2-(furan-2-yl)-1H-benzimidazol-4-yl]methanamine is NCc1cccc2[nH]c(-c3ccco3)nc12.
What is the InChIKey of [2-(furan-2-yl)-1H-benzimidazol-4-yl]methanamine?
The InChIKey is NUFZSHWBUWVOAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N3O/c13-7-8-3-1-4-9-11(8)15-12(14-9)10-5-2-6-16-10/h1-6H,7,13H2,(H,14,15).
What are the key properties of [2-(furan-2-yl)-1H-benzimidazol-4-yl]methanamine?
[2-(furan-2-yl)-1H-benzimidazol-4-yl]methanamine has a molecular weight of 213.24 g/mol, XLogP of 2.28, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(furan-2-yl)-1H-benzimidazol-4-yl]methanamine is sourced from PubChem (CID 104721099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).