4-[[2-(4-phenylphenyl)phenyl]methyl]pyridine-2-carboxamide

C25H20N2O — CID 70606664

IUPAC4-[[2-(4-phenylphenyl)phenyl]methyl]pyridine-2-carboxamide
SMILESNC(=O)c1cc(Cc2ccccc2-c2ccc(-c3ccccc3)cc2)ccn1
InChIInChI=1S/C25H20N2O/c26-25(28)24-17-18(14-15-27-24)16-22-8-4-5-9-23(22)21-12-10-20(11-13-21)19-6-2-1-3-7-19/h1-15,17H,16H2,(H2,26,28)
InChIKeyOMGGGCTWNCBZJI-UHFFFAOYSA-N
MW364.45 g/mol
LogP5.11
Rot. Bonds5

About 4-[[2-(4-phenylphenyl)phenyl]methyl]pyridine-2-carboxamide

4-[[2-(4-phenylphenyl)phenyl]methyl]pyridine-2-carboxamide (PubChem CID 70606664) has the molecular formula C25H20N2O and a molecular weight of 364.45 g/mol. Its IUPAC name is 4-[[2-(4-phenylphenyl)phenyl]methyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name4-[[2-(4-phenylphenyl)phenyl]methyl]pyridine-2-carboxamide
PubChem CID70606664
Molecular FormulaC25H20N2O
Molecular Weight364.45 g/mol
Exact Mass364.16
IUPAC Name4-[[2-(4-phenylphenyl)phenyl]methyl]pyridine-2-carboxamide
SMILESNC(=O)c1cc(Cc2ccccc2-c2ccc(-c3ccccc3)cc2)ccn1
InChIInChI=1S/C25H20N2O/c26-25(28)24-17-18(14-15-27-24)16-22-8-4-5-9-23(22)21-12-10-20(11-13-21)19-6-2-1-3-7-19/h1-15,17H,16H2,(H2,26,28)
InChIKeyOMGGGCTWNCBZJI-UHFFFAOYSA-N
XLogP5.11
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms28
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500364.45
LogP ≤ 55.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-[[2-(4-phenylphenyl)phenyl]methyl]pyridine-2-carboxamide?
The IUPAC name of 4-[[2-(4-phenylphenyl)phenyl]methyl]pyridine-2-carboxamide (CID 70606664) is 4-[[2-(4-phenylphenyl)phenyl]methyl]pyridine-2-carboxamide.
What is the SMILES notation for 4-[[2-(4-phenylphenyl)phenyl]methyl]pyridine-2-carboxamide?
The canonical SMILES for 4-[[2-(4-phenylphenyl)phenyl]methyl]pyridine-2-carboxamide is NC(=O)c1cc(Cc2ccccc2-c2ccc(-c3ccccc3)cc2)ccn1.
What is the InChIKey of 4-[[2-(4-phenylphenyl)phenyl]methyl]pyridine-2-carboxamide?
The InChIKey is OMGGGCTWNCBZJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H20N2O/c26-25(28)24-17-18(14-15-27-24)16-22-8-4-5-9-23(22)21-12-10-20(11-13-21)19-6-2-1-3-7-19/h1-15,17H,16H2,(H2,26,28).
What are the key properties of 4-[[2-(4-phenylphenyl)phenyl]methyl]pyridine-2-carboxamide?
4-[[2-(4-phenylphenyl)phenyl]methyl]pyridine-2-carboxamide has a molecular weight of 364.45 g/mol, XLogP of 5.11, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[2-(4-phenylphenyl)phenyl]methyl]pyridine-2-carboxamide is sourced from PubChem (CID 70606664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).