2-phenylmethoxy-N-(2-phenylphenyl)pyridine-4-carboxamide

C25H20N2O2 — CID 60566988

IUPAC2-phenylmethoxy-N-(2-phenylphenyl)pyridine-4-carboxamide
SMILESO=C(Nc1ccccc1-c1ccccc1)c1ccnc(OCc2ccccc2)c1
InChIInChI=1S/C25H20N2O2/c28-25(27-23-14-8-7-13-22(23)20-11-5-2-6-12-20)21-15-16-26-24(17-21)29-18-19-9-3-1-4-10-19/h1-17H,18H2,(H,27,28)
InChIKeyVLUCRWKLPSEHTG-UHFFFAOYSA-N
MW380.45 g/mol
LogP5.58
Rot. Bonds6

About 2-phenylmethoxy-N-(2-phenylphenyl)pyridine-4-carboxamide

2-phenylmethoxy-N-(2-phenylphenyl)pyridine-4-carboxamide (PubChem CID 60566988) has the molecular formula C25H20N2O2 and a molecular weight of 380.45 g/mol. Its IUPAC name is 2-phenylmethoxy-N-(2-phenylphenyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-phenylmethoxy-N-(2-phenylphenyl)pyridine-4-carboxamide
PubChem CID60566988
Molecular FormulaC25H20N2O2
Molecular Weight380.45 g/mol
Exact Mass380.15
IUPAC Name2-phenylmethoxy-N-(2-phenylphenyl)pyridine-4-carboxamide
SMILESO=C(Nc1ccccc1-c1ccccc1)c1ccnc(OCc2ccccc2)c1
InChIInChI=1S/C25H20N2O2/c28-25(27-23-14-8-7-13-22(23)20-11-5-2-6-12-20)21-15-16-26-24(17-21)29-18-19-9-3-1-4-10-19/h1-17H,18H2,(H,27,28)
InChIKeyVLUCRWKLPSEHTG-UHFFFAOYSA-N
XLogP5.58
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms29
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500380.45
LogP ≤ 55.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-phenylmethoxy-N-(2-phenylphenyl)pyridine-4-carboxamide?
The IUPAC name of 2-phenylmethoxy-N-(2-phenylphenyl)pyridine-4-carboxamide (CID 60566988) is 2-phenylmethoxy-N-(2-phenylphenyl)pyridine-4-carboxamide.
What is the SMILES notation for 2-phenylmethoxy-N-(2-phenylphenyl)pyridine-4-carboxamide?
The canonical SMILES for 2-phenylmethoxy-N-(2-phenylphenyl)pyridine-4-carboxamide is O=C(Nc1ccccc1-c1ccccc1)c1ccnc(OCc2ccccc2)c1.
What is the InChIKey of 2-phenylmethoxy-N-(2-phenylphenyl)pyridine-4-carboxamide?
The InChIKey is VLUCRWKLPSEHTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H20N2O2/c28-25(27-23-14-8-7-13-22(23)20-11-5-2-6-12-20)21-15-16-26-24(17-21)29-18-19-9-3-1-4-10-19/h1-17H,18H2,(H,27,28).
What are the key properties of 2-phenylmethoxy-N-(2-phenylphenyl)pyridine-4-carboxamide?
2-phenylmethoxy-N-(2-phenylphenyl)pyridine-4-carboxamide has a molecular weight of 380.45 g/mol, XLogP of 5.58, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenylmethoxy-N-(2-phenylphenyl)pyridine-4-carboxamide is sourced from PubChem (CID 60566988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).