3-(1H-benzimidazol-2-yl)-5-pyridin-4-ylpyridin-2-amine

C17H13N5 — CID 50923466

IUPAC3-(1H-benzimidazol-2-yl)-5-pyridin-4-ylpyridin-2-amine
SMILESNc1ncc(-c2ccncc2)cc1-c1nc2ccccc2[nH]1
InChIInChI=1S/C17H13N5/c18-16-13(17-21-14-3-1-2-4-15(14)22-17)9-12(10-20-16)11-5-7-19-8-6-11/h1-10H,(H2,18,20)(H,21,22)
InChIKeyYEBVTPOZFWYQJG-UHFFFAOYSA-N
MW287.33 g/mol
LogP3.27
Rot. Bonds2

About 3-(1H-benzimidazol-2-yl)-5-pyridin-4-ylpyridin-2-amine

3-(1H-benzimidazol-2-yl)-5-pyridin-4-ylpyridin-2-amine (PubChem CID 50923466) has the molecular formula C17H13N5 and a molecular weight of 287.33 g/mol. Its IUPAC name is 3-(1H-benzimidazol-2-yl)-5-pyridin-4-ylpyridin-2-amine.

Molecular Properties

Compound Name3-(1H-benzimidazol-2-yl)-5-pyridin-4-ylpyridin-2-amine
PubChem CID50923466
Molecular FormulaC17H13N5
Molecular Weight287.33 g/mol
Exact Mass287.12
IUPAC Name3-(1H-benzimidazol-2-yl)-5-pyridin-4-ylpyridin-2-amine
SMILESNc1ncc(-c2ccncc2)cc1-c1nc2ccccc2[nH]1
InChIInChI=1S/C17H13N5/c18-16-13(17-21-14-3-1-2-4-15(14)22-17)9-12(10-20-16)11-5-7-19-8-6-11/h1-10H,(H2,18,20)(H,21,22)
InChIKeyYEBVTPOZFWYQJG-UHFFFAOYSA-N
XLogP3.27
TPSA80.48 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.33
LogP ≤ 53.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 3-(1H-benzimidazol-2-yl)-5-pyridin-4-ylpyridin-2-amine 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

5-(1H-benzimidazol-2-yl)pyrimidine-2,4-diamine
CID 102284104
3-(1H-benzimidazol-2-yl)-1,8-naphthyridin-2-amine
CID 13479171
2,6-bis(1H-benzimidazol-2-yl)-4-[3,5-bis(1H-benzimidazol-2-yl)-4-hydroxyphenyl]phenol
CID 139797671
2-(4-chloro-3-pyridinyl)-1H-benzimidazole
CID 67996480
2-[4-[4-(1H-benzimidazol-2-yl)phenyl]phenyl]-1H-benzimidazole
CID 12522580
2-(1H-benzimidazol-2-yl)aniline;dihydrochloride
CID 133057606
3-(6-benzyl-1H-benzimidazol-2-yl)-5-(1-methylpyrazol-4-yl)pyridin-2-amine
CID 50924475
[2-[2-amino-5-(1-methylpyrazol-4-yl)-3-pyridinyl]-3H-benzimidazol-5-yl]-phenylmethanone
CID 50924471
2-[4-[3,5-bis[4-(1H-benzimidazol-2-yl)phenyl]phenyl]phenyl]-1H-benzimidazole
CID 102200427
3-pyridin-4-ylquinoline
CID 10081720
3-(1H-benzimidazol-2-yl)-6-fluoroquinolin-4-amine
CID 68765479
5-(3-fluorophenyl)-3-(6-methylsulfonyl-1H-benzimidazol-2-yl)pyridin-2-amine
CID 44525310

Frequently Asked Questions

What is the IUPAC name of 3-(1H-benzimidazol-2-yl)-5-pyridin-4-ylpyridin-2-amine?
The IUPAC name of 3-(1H-benzimidazol-2-yl)-5-pyridin-4-ylpyridin-2-amine (CID 50923466) is 3-(1H-benzimidazol-2-yl)-5-pyridin-4-ylpyridin-2-amine.
What is the SMILES notation for 3-(1H-benzimidazol-2-yl)-5-pyridin-4-ylpyridin-2-amine?
The canonical SMILES for 3-(1H-benzimidazol-2-yl)-5-pyridin-4-ylpyridin-2-amine is Nc1ncc(-c2ccncc2)cc1-c1nc2ccccc2[nH]1.
What is the InChIKey of 3-(1H-benzimidazol-2-yl)-5-pyridin-4-ylpyridin-2-amine?
The InChIKey is YEBVTPOZFWYQJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13N5/c18-16-13(17-21-14-3-1-2-4-15(14)22-17)9-12(10-20-16)11-5-7-19-8-6-11/h1-10H,(H2,18,20)(H,21,22).
What are the key properties of 3-(1H-benzimidazol-2-yl)-5-pyridin-4-ylpyridin-2-amine?
3-(1H-benzimidazol-2-yl)-5-pyridin-4-ylpyridin-2-amine has a molecular weight of 287.33 g/mol, XLogP of 3.27, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1H-benzimidazol-2-yl)-5-pyridin-4-ylpyridin-2-amine is sourced from PubChem (CID 50923466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).