N-(4-oxo-2,6-diphenylpyran-3-yl)benzamide

C24H17NO3 — CID 981585

IUPACN-(4-oxo-2,6-diphenylpyran-3-yl)benzamide
SMILESO=C(Nc1c(-c2ccccc2)oc(-c2ccccc2)cc1=O)c1ccccc1
InChIInChI=1S/C24H17NO3/c26-20-16-21(17-10-4-1-5-11-17)28-23(18-12-6-2-7-13-18)22(20)25-24(27)19-14-8-3-9-15-19/h1-16H,(H,25,27)
InChIKeyYANLZTLHRMGDEZ-UHFFFAOYSA-N
MW367.40 g/mol
LogP5.23
Rot. Bonds4

About N-(4-oxo-2,6-diphenylpyran-3-yl)benzamide

N-(4-oxo-2,6-diphenylpyran-3-yl)benzamide (PubChem CID 981585) has the molecular formula C24H17NO3 and a molecular weight of 367.40 g/mol. Its IUPAC name is N-(4-oxo-2,6-diphenylpyran-3-yl)benzamide.

Molecular Properties

Compound NameN-(4-oxo-2,6-diphenylpyran-3-yl)benzamide
PubChem CID981585
Molecular FormulaC24H17NO3
Molecular Weight367.40 g/mol
Exact Mass367.12
IUPAC NameN-(4-oxo-2,6-diphenylpyran-3-yl)benzamide
SMILESO=C(Nc1c(-c2ccccc2)oc(-c2ccccc2)cc1=O)c1ccccc1
InChIInChI=1S/C24H17NO3/c26-20-16-21(17-10-4-1-5-11-17)28-23(18-12-6-2-7-13-18)22(20)25-24(27)19-14-8-3-9-15-19/h1-16H,(H,25,27)
InChIKeyYANLZTLHRMGDEZ-UHFFFAOYSA-N
XLogP5.23
TPSA59.31 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500367.40
LogP ≤ 55.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4-oxo-2,6-diphenylpyran-3-yl)benzamide?
The IUPAC name of N-(4-oxo-2,6-diphenylpyran-3-yl)benzamide (CID 981585) is N-(4-oxo-2,6-diphenylpyran-3-yl)benzamide.
What is the SMILES notation for N-(4-oxo-2,6-diphenylpyran-3-yl)benzamide?
The canonical SMILES for N-(4-oxo-2,6-diphenylpyran-3-yl)benzamide is O=C(Nc1c(-c2ccccc2)oc(-c2ccccc2)cc1=O)c1ccccc1.
What is the InChIKey of N-(4-oxo-2,6-diphenylpyran-3-yl)benzamide?
The InChIKey is YANLZTLHRMGDEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H17NO3/c26-20-16-21(17-10-4-1-5-11-17)28-23(18-12-6-2-7-13-18)22(20)25-24(27)19-14-8-3-9-15-19/h1-16H,(H,25,27).
What are the key properties of N-(4-oxo-2,6-diphenylpyran-3-yl)benzamide?
N-(4-oxo-2,6-diphenylpyran-3-yl)benzamide has a molecular weight of 367.40 g/mol, XLogP of 5.23, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-oxo-2,6-diphenylpyran-3-yl)benzamide is sourced from PubChem (CID 981585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).