2-(2-pyridin-2-yl-3H-benzimidazol-5-yl)ethanamine

C14H14N4 — CID 82292186

IUPAC2-(2-pyridin-2-yl-3H-benzimidazol-5-yl)ethanamine
SMILESNCCc1ccc2nc(-c3ccccn3)[nH]c2c1
InChIInChI=1S/C14H14N4/c15-7-6-10-4-5-11-13(9-10)18-14(17-11)12-3-1-2-8-16-12/h1-5,8-9H,6-7,15H2,(H,17,18)
InChIKeyNMWXIIRHJNEERY-UHFFFAOYSA-N
MW238.29 g/mol
LogP2.13
Rot. Bonds3

About 2-(2-pyridin-2-yl-3H-benzimidazol-5-yl)ethanamine

2-(2-pyridin-2-yl-3H-benzimidazol-5-yl)ethanamine (PubChem CID 82292186) has the molecular formula C14H14N4 and a molecular weight of 238.29 g/mol. Its IUPAC name is 2-(2-pyridin-2-yl-3H-benzimidazol-5-yl)ethanamine.

Molecular Properties

Compound Name2-(2-pyridin-2-yl-3H-benzimidazol-5-yl)ethanamine
PubChem CID82292186
Molecular FormulaC14H14N4
Molecular Weight238.29 g/mol
Exact Mass238.12
IUPAC Name2-(2-pyridin-2-yl-3H-benzimidazol-5-yl)ethanamine
SMILESNCCc1ccc2nc(-c3ccccn3)[nH]c2c1
InChIInChI=1S/C14H14N4/c15-7-6-10-4-5-11-13(9-10)18-14(17-11)12-3-1-2-8-16-12/h1-5,8-9H,6-7,15H2,(H,17,18)
InChIKeyNMWXIIRHJNEERY-UHFFFAOYSA-N
XLogP2.13
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 52.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-pyridin-2-yl-3H-benzimidazol-5-amine;trihydrochloride
CID 118989540
2-(2-pyridin-3-yl-3H-benzimidazol-5-yl)ethanamine
CID 82292187
platinum;2-pyridin-2-yl-1H-benzimidazole
CID 174864241
2-pyridin-2-yl-3H-benzimidazole-5-carboxylate
CID 7044978
copper;palladium;2-pyridin-2-yl-1H-benzimidazole
CID 174748574
2-pyridin-2-yl-3H-benzimidazole-5-carbaldehyde
CID 84756492
2-[2-(3,4-dimethylphenyl)-3H-benzimidazol-5-yl]ethanamine
CID 82304182
3-[2-(4-fluorophenyl)-3H-benzimidazol-5-yl]propan-1-amine
CID 82305555
2-[2-[hydroxy(dimethyl)-λ4-sulfanyl]-3H-benzimidazol-5-yl]ethanamine
CID 123909536
6-[(2-fluorophenyl)methylsulfanyl]-2-pyridin-2-yl-1H-benzimidazole
CID 52934917
[2-(5-fluoro-2-pyridinyl)-3H-benzimidazol-5-yl]methanamine
CID 113436420
(2-pyridin-2-yl-3H-benzimidazol-5-yl) formate
CID 86766119

Frequently Asked Questions

What is the IUPAC name of 2-(2-pyridin-2-yl-3H-benzimidazol-5-yl)ethanamine?
The IUPAC name of 2-(2-pyridin-2-yl-3H-benzimidazol-5-yl)ethanamine (CID 82292186) is 2-(2-pyridin-2-yl-3H-benzimidazol-5-yl)ethanamine.
What is the SMILES notation for 2-(2-pyridin-2-yl-3H-benzimidazol-5-yl)ethanamine?
The canonical SMILES for 2-(2-pyridin-2-yl-3H-benzimidazol-5-yl)ethanamine is NCCc1ccc2nc(-c3ccccn3)[nH]c2c1.
What is the InChIKey of 2-(2-pyridin-2-yl-3H-benzimidazol-5-yl)ethanamine?
The InChIKey is NMWXIIRHJNEERY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4/c15-7-6-10-4-5-11-13(9-10)18-14(17-11)12-3-1-2-8-16-12/h1-5,8-9H,6-7,15H2,(H,17,18).
What are the key properties of 2-(2-pyridin-2-yl-3H-benzimidazol-5-yl)ethanamine?
2-(2-pyridin-2-yl-3H-benzimidazol-5-yl)ethanamine has a molecular weight of 238.29 g/mol, XLogP of 2.13, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-pyridin-2-yl-3H-benzimidazol-5-yl)ethanamine is sourced from PubChem (CID 82292186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).