3-(1H-benzimidazol-2-yl)-5-phenylpyridin-2-amine

C18H14N4 — CID 10379252

IUPAC3-(1H-benzimidazol-2-yl)-5-phenylpyridin-2-amine
SMILESNc1ncc(-c2ccccc2)cc1-c1nc2ccccc2[nH]1
InChIInChI=1S/C18H14N4/c19-17-14(18-21-15-8-4-5-9-16(15)22-18)10-13(11-20-17)12-6-2-1-3-7-12/h1-11H,(H2,19,20)(H,21,22)
InChIKeyCLRWMPFUTCKUQH-UHFFFAOYSA-N
MW286.34 g/mol
LogP3.87
Rot. Bonds2

About 3-(1H-benzimidazol-2-yl)-5-phenylpyridin-2-amine

3-(1H-benzimidazol-2-yl)-5-phenylpyridin-2-amine (PubChem CID 10379252) has the molecular formula C18H14N4 and a molecular weight of 286.34 g/mol. Its IUPAC name is 3-(1H-benzimidazol-2-yl)-5-phenylpyridin-2-amine.

Molecular Properties

Compound Name3-(1H-benzimidazol-2-yl)-5-phenylpyridin-2-amine
PubChem CID10379252
Molecular FormulaC18H14N4
Molecular Weight286.34 g/mol
Exact Mass286.12
IUPAC Name3-(1H-benzimidazol-2-yl)-5-phenylpyridin-2-amine
SMILESNc1ncc(-c2ccccc2)cc1-c1nc2ccccc2[nH]1
InChIInChI=1S/C18H14N4/c19-17-14(18-21-15-8-4-5-9-16(15)22-18)10-13(11-20-17)12-6-2-1-3-7-12/h1-11H,(H2,19,20)(H,21,22)
InChIKeyCLRWMPFUTCKUQH-UHFFFAOYSA-N
XLogP3.87
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.34
LogP ≤ 53.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(1H-benzimidazol-2-yl)-5-phenylpyridin-2-amine?
The IUPAC name of 3-(1H-benzimidazol-2-yl)-5-phenylpyridin-2-amine (CID 10379252) is 3-(1H-benzimidazol-2-yl)-5-phenylpyridin-2-amine.
What is the SMILES notation for 3-(1H-benzimidazol-2-yl)-5-phenylpyridin-2-amine?
The canonical SMILES for 3-(1H-benzimidazol-2-yl)-5-phenylpyridin-2-amine is Nc1ncc(-c2ccccc2)cc1-c1nc2ccccc2[nH]1.
What is the InChIKey of 3-(1H-benzimidazol-2-yl)-5-phenylpyridin-2-amine?
The InChIKey is CLRWMPFUTCKUQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N4/c19-17-14(18-21-15-8-4-5-9-16(15)22-18)10-13(11-20-17)12-6-2-1-3-7-12/h1-11H,(H2,19,20)(H,21,22).
What are the key properties of 3-(1H-benzimidazol-2-yl)-5-phenylpyridin-2-amine?
3-(1H-benzimidazol-2-yl)-5-phenylpyridin-2-amine has a molecular weight of 286.34 g/mol, XLogP of 3.87, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1H-benzimidazol-2-yl)-5-phenylpyridin-2-amine is sourced from PubChem (CID 10379252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).