N-(2-carbamoylphenyl)-2-oxo-1-phenylmethoxypyridine-3-carboxamide

C20H17N3O4 — CID 110382870

IUPACN-(2-carbamoylphenyl)-2-oxo-1-phenylmethoxypyridine-3-carboxamide
SMILESNC(=O)c1ccccc1NC(=O)c1cccn(OCc2ccccc2)c1=O
InChIInChI=1S/C20H17N3O4/c21-18(24)15-9-4-5-11-17(15)22-19(25)16-10-6-12-23(20(16)26)27-13-14-7-2-1-3-8-14/h1-12H,13H2,(H2,21,24)(H,22,25)
InChIKeyGRNLNUFDCXCWPM-UHFFFAOYSA-N
MW363.37 g/mol
LogP1.83
Rot. Bonds6

About N-(2-carbamoylphenyl)-2-oxo-1-phenylmethoxypyridine-3-carboxamide

N-(2-carbamoylphenyl)-2-oxo-1-phenylmethoxypyridine-3-carboxamide (PubChem CID 110382870) has the molecular formula C20H17N3O4 and a molecular weight of 363.37 g/mol. Its IUPAC name is N-(2-carbamoylphenyl)-2-oxo-1-phenylmethoxypyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-carbamoylphenyl)-2-oxo-1-phenylmethoxypyridine-3-carboxamide
PubChem CID110382870
Molecular FormulaC20H17N3O4
Molecular Weight363.37 g/mol
Exact Mass363.12
IUPAC NameN-(2-carbamoylphenyl)-2-oxo-1-phenylmethoxypyridine-3-carboxamide
SMILESNC(=O)c1ccccc1NC(=O)c1cccn(OCc2ccccc2)c1=O
InChIInChI=1S/C20H17N3O4/c21-18(24)15-9-4-5-11-17(15)22-19(25)16-10-6-12-23(20(16)26)27-13-14-7-2-1-3-8-14/h1-12H,13H2,(H2,21,24)(H,22,25)
InChIKeyGRNLNUFDCXCWPM-UHFFFAOYSA-N
XLogP1.83
TPSA103.42 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.37
LogP ≤ 51.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2-carbamoylphenyl)-2-oxo-1-phenylmethoxypyridine-3-carboxamide?
The IUPAC name of N-(2-carbamoylphenyl)-2-oxo-1-phenylmethoxypyridine-3-carboxamide (CID 110382870) is N-(2-carbamoylphenyl)-2-oxo-1-phenylmethoxypyridine-3-carboxamide.
What is the SMILES notation for N-(2-carbamoylphenyl)-2-oxo-1-phenylmethoxypyridine-3-carboxamide?
The canonical SMILES for N-(2-carbamoylphenyl)-2-oxo-1-phenylmethoxypyridine-3-carboxamide is NC(=O)c1ccccc1NC(=O)c1cccn(OCc2ccccc2)c1=O.
What is the InChIKey of N-(2-carbamoylphenyl)-2-oxo-1-phenylmethoxypyridine-3-carboxamide?
The InChIKey is GRNLNUFDCXCWPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N3O4/c21-18(24)15-9-4-5-11-17(15)22-19(25)16-10-6-12-23(20(16)26)27-13-14-7-2-1-3-8-14/h1-12H,13H2,(H2,21,24)(H,22,25).
What are the key properties of N-(2-carbamoylphenyl)-2-oxo-1-phenylmethoxypyridine-3-carboxamide?
N-(2-carbamoylphenyl)-2-oxo-1-phenylmethoxypyridine-3-carboxamide has a molecular weight of 363.37 g/mol, XLogP of 1.83, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-carbamoylphenyl)-2-oxo-1-phenylmethoxypyridine-3-carboxamide is sourced from PubChem (CID 110382870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).