2-(2-pyridin-3-ylbenzimidazol-1-yl)ethanamine

C14H14N4 — CID 28752905

IUPAC2-(2-pyridin-3-ylbenzimidazol-1-yl)ethanamine
SMILESNCCn1c(-c2cccnc2)nc2ccccc21
InChIInChI=1S/C14H14N4/c15-7-9-18-13-6-2-1-5-12(13)17-14(18)11-4-3-8-16-10-11/h1-6,8,10H,7,9,15H2
InChIKeyYEWLLJIYDXUPOK-UHFFFAOYSA-N
MW238.29 g/mol
LogP2.06
Rot. Bonds3

About 2-(2-pyridin-3-ylbenzimidazol-1-yl)ethanamine

2-(2-pyridin-3-ylbenzimidazol-1-yl)ethanamine (PubChem CID 28752905) has the molecular formula C14H14N4 and a molecular weight of 238.29 g/mol. Its IUPAC name is 2-(2-pyridin-3-ylbenzimidazol-1-yl)ethanamine.

Molecular Properties

Compound Name2-(2-pyridin-3-ylbenzimidazol-1-yl)ethanamine
PubChem CID28752905
Molecular FormulaC14H14N4
Molecular Weight238.29 g/mol
Exact Mass238.12
IUPAC Name2-(2-pyridin-3-ylbenzimidazol-1-yl)ethanamine
SMILESNCCn1c(-c2cccnc2)nc2ccccc21
InChIInChI=1S/C14H14N4/c15-7-9-18-13-6-2-1-5-12(13)17-14(18)11-4-3-8-16-10-11/h1-6,8,10H,7,9,15H2
InChIKeyYEWLLJIYDXUPOK-UHFFFAOYSA-N
XLogP2.06
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-pyridin-3-yl-1-undecylbenzimidazole
CID 18878842
2-(5,6-dichloro-2-pyridin-3-ylbenzimidazol-1-yl)ethanamine
CID 94749231
ethyl 2-(2-pyridin-3-ylbenzimidazol-1-yl)acetate
CID 16644397
2-(2-pyridin-3-yl-6,7-dihydro-[1,4]dioxino[2,3-f]benzimidazol-3-yl)ethanamine
CID 82145913
2-(5-methyl-2-pyridin-3-ylimidazol-1-yl)ethanamine;dihydrochloride
CID 146064771
1-phenyl-2-pyridin-3-ylbenzimidazole
CID 24821366
2-[2-(5,6-dimethyl-2-pyridin-3-ylbenzimidazol-1-yl)ethoxy]ethanamine
CID 94748156
[2-[4-[1-(aminomethyl)benzimidazol-2-yl]phenyl]benzimidazol-1-yl]methanamine
CID 158757236
2-[2-[4-[1-(2-hydroxyethyl)benzimidazol-2-yl]phenyl]benzimidazol-1-yl]ethanol
CID 174213303
1-prop-2-enyl-2-pyridin-3-ylbenzimidazol-5-amine
CID 83969024
2-phenyl-1-(2-pyridin-2-ylethyl)benzimidazole
CID 12758390
3-(2-pyridin-4-ylbenzimidazol-1-yl)propanethioamide
CID 82149829

Frequently Asked Questions

What is the IUPAC name of 2-(2-pyridin-3-ylbenzimidazol-1-yl)ethanamine?
The IUPAC name of 2-(2-pyridin-3-ylbenzimidazol-1-yl)ethanamine (CID 28752905) is 2-(2-pyridin-3-ylbenzimidazol-1-yl)ethanamine.
What is the SMILES notation for 2-(2-pyridin-3-ylbenzimidazol-1-yl)ethanamine?
The canonical SMILES for 2-(2-pyridin-3-ylbenzimidazol-1-yl)ethanamine is NCCn1c(-c2cccnc2)nc2ccccc21.
What is the InChIKey of 2-(2-pyridin-3-ylbenzimidazol-1-yl)ethanamine?
The InChIKey is YEWLLJIYDXUPOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4/c15-7-9-18-13-6-2-1-5-12(13)17-14(18)11-4-3-8-16-10-11/h1-6,8,10H,7,9,15H2.
What are the key properties of 2-(2-pyridin-3-ylbenzimidazol-1-yl)ethanamine?
2-(2-pyridin-3-ylbenzimidazol-1-yl)ethanamine has a molecular weight of 238.29 g/mol, XLogP of 2.06, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-pyridin-3-ylbenzimidazol-1-yl)ethanamine is sourced from PubChem (CID 28752905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).