N-(2-carbamoylphenyl)-1-[(3-chlorophenyl)methoxy]-2-oxopyridine-3-carboxamide

C20H16ClN3O4 — CID 110382847

IUPACN-(2-carbamoylphenyl)-1-[(3-chlorophenyl)methoxy]-2-oxopyridine-3-carboxamide
SMILESNC(=O)c1ccccc1NC(=O)c1cccn(OCc2cccc(Cl)c2)c1=O
InChIInChI=1S/C20H16ClN3O4/c21-14-6-3-5-13(11-14)12-28-24-10-4-8-16(20(24)27)19(26)23-17-9-2-1-7-15(17)18(22)25/h1-11H,12H2,(H2,22,25)(H,23,26)
InChIKeyHKLXFXNPUYPOFJ-UHFFFAOYSA-N
MW397.82 g/mol
LogP2.48
Rot. Bonds6

About N-(2-carbamoylphenyl)-1-[(3-chlorophenyl)methoxy]-2-oxopyridine-3-carboxamide

N-(2-carbamoylphenyl)-1-[(3-chlorophenyl)methoxy]-2-oxopyridine-3-carboxamide (PubChem CID 110382847) has the molecular formula C20H16ClN3O4 and a molecular weight of 397.82 g/mol. Its IUPAC name is N-(2-carbamoylphenyl)-1-[(3-chlorophenyl)methoxy]-2-oxopyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-carbamoylphenyl)-1-[(3-chlorophenyl)methoxy]-2-oxopyridine-3-carboxamide
PubChem CID110382847
Molecular FormulaC20H16ClN3O4
Molecular Weight397.82 g/mol
Exact Mass397.08
IUPAC NameN-(2-carbamoylphenyl)-1-[(3-chlorophenyl)methoxy]-2-oxopyridine-3-carboxamide
SMILESNC(=O)c1ccccc1NC(=O)c1cccn(OCc2cccc(Cl)c2)c1=O
InChIInChI=1S/C20H16ClN3O4/c21-14-6-3-5-13(11-14)12-28-24-10-4-8-16(20(24)27)19(26)23-17-9-2-1-7-15(17)18(22)25/h1-11H,12H2,(H2,22,25)(H,23,26)
InChIKeyHKLXFXNPUYPOFJ-UHFFFAOYSA-N
XLogP2.48
TPSA103.42 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500397.82
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2-carbamoylphenyl)-1-[(3-chlorophenyl)methoxy]-2-oxopyridine-3-carboxamide?
The IUPAC name of N-(2-carbamoylphenyl)-1-[(3-chlorophenyl)methoxy]-2-oxopyridine-3-carboxamide (CID 110382847) is N-(2-carbamoylphenyl)-1-[(3-chlorophenyl)methoxy]-2-oxopyridine-3-carboxamide.
What is the SMILES notation for N-(2-carbamoylphenyl)-1-[(3-chlorophenyl)methoxy]-2-oxopyridine-3-carboxamide?
The canonical SMILES for N-(2-carbamoylphenyl)-1-[(3-chlorophenyl)methoxy]-2-oxopyridine-3-carboxamide is NC(=O)c1ccccc1NC(=O)c1cccn(OCc2cccc(Cl)c2)c1=O.
What is the InChIKey of N-(2-carbamoylphenyl)-1-[(3-chlorophenyl)methoxy]-2-oxopyridine-3-carboxamide?
The InChIKey is HKLXFXNPUYPOFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16ClN3O4/c21-14-6-3-5-13(11-14)12-28-24-10-4-8-16(20(24)27)19(26)23-17-9-2-1-7-15(17)18(22)25/h1-11H,12H2,(H2,22,25)(H,23,26).
What are the key properties of N-(2-carbamoylphenyl)-1-[(3-chlorophenyl)methoxy]-2-oxopyridine-3-carboxamide?
N-(2-carbamoylphenyl)-1-[(3-chlorophenyl)methoxy]-2-oxopyridine-3-carboxamide has a molecular weight of 397.82 g/mol, XLogP of 2.48, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-carbamoylphenyl)-1-[(3-chlorophenyl)methoxy]-2-oxopyridine-3-carboxamide is sourced from PubChem (CID 110382847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).