N-(1,3-benzodioxol-5-yl)-1-[(3-chlorophenyl)methoxy]-2-oxopyridine-3-carboxamide

C20H15ClN2O5 — CID 40505037

IUPACN-(1,3-benzodioxol-5-yl)-1-[(3-chlorophenyl)methoxy]-2-oxopyridine-3-carboxamide
SMILESO=C(Nc1ccc2c(c1)OCO2)c1cccn(OCc2cccc(Cl)c2)c1=O
InChIInChI=1S/C20H15ClN2O5/c21-14-4-1-3-13(9-14)11-28-23-8-2-5-16(20(23)25)19(24)22-15-6-7-17-18(10-15)27-12-26-17/h1-10H,11-12H2,(H,22,24)
InChIKeySEHFKEUIGULDSA-UHFFFAOYSA-N
MW398.80 g/mol
LogP3.11
Rot. Bonds5

About N-(1,3-benzodioxol-5-yl)-1-[(3-chlorophenyl)methoxy]-2-oxopyridine-3-carboxamide

N-(1,3-benzodioxol-5-yl)-1-[(3-chlorophenyl)methoxy]-2-oxopyridine-3-carboxamide (PubChem CID 40505037) has the molecular formula C20H15ClN2O5 and a molecular weight of 398.80 g/mol. Its IUPAC name is N-(1,3-benzodioxol-5-yl)-1-[(3-chlorophenyl)methoxy]-2-oxopyridine-3-carboxamide.

Molecular Properties

Compound NameN-(1,3-benzodioxol-5-yl)-1-[(3-chlorophenyl)methoxy]-2-oxopyridine-3-carboxamide
PubChem CID40505037
Molecular FormulaC20H15ClN2O5
Molecular Weight398.80 g/mol
Exact Mass398.07
IUPAC NameN-(1,3-benzodioxol-5-yl)-1-[(3-chlorophenyl)methoxy]-2-oxopyridine-3-carboxamide
SMILESO=C(Nc1ccc2c(c1)OCO2)c1cccn(OCc2cccc(Cl)c2)c1=O
InChIInChI=1S/C20H15ClN2O5/c21-14-4-1-3-13(9-14)11-28-23-8-2-5-16(20(23)25)19(24)22-15-6-7-17-18(10-15)27-12-26-17/h1-10H,11-12H2,(H,22,24)
InChIKeySEHFKEUIGULDSA-UHFFFAOYSA-N
XLogP3.11
TPSA78.79 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.80
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1-[(3-chlorophenyl)methoxy]-N-(3,4-dimethylphenyl)-2-oxopyridine-3-carboxamide
CID 40505050
1-[(3-chlorophenyl)methoxy]-N-(4-nitrophenyl)-2-oxopyridine-3-carboxamide
CID 40505003
1-[(3-chlorophenyl)methoxy]-N-(2-cyanophenyl)-2-oxopyridine-3-carboxamide
CID 110382844
N-(1,3-benzodioxol-5-yl)-1-[(3-methoxyphenyl)methyl]-2-oxopyridine-3-carboxamide
CID 110382307
1-[(4-chlorophenyl)methoxy]-N-(3-methoxyphenyl)-2-oxopyridine-3-carboxamide
CID 110382717
N-(4-carbamoylphenyl)-1-[(4-chlorophenyl)methoxy]-2-oxopyridine-3-carboxamide
CID 110382726
N-(3-acetylphenyl)-2-oxo-1-phenylmethoxypyridine-3-carboxamide
CID 40505024
5-N-(1,3-benzodioxol-5-yl)-3-N-(3-chlorophenyl)pyridine-3,5-dicarboxamide
CID 109108795
N-(4-ethylphenyl)-1-[(3-methoxyphenyl)methoxy]-2-oxopyridine-3-carboxamide
CID 110382737
1-[(3-chlorophenyl)methyl]-N-(3,4-dichlorophenyl)-2-oxopyridine-3-carboxamide
CID 8670922
N-(4-carbamoylphenyl)-2-oxo-1-phenylmethoxypyridine-3-carboxamide
CID 110382871
2-(3-chlorophenyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
CID 56923008

Frequently Asked Questions

What is the IUPAC name of N-(1,3-benzodioxol-5-yl)-1-[(3-chlorophenyl)methoxy]-2-oxopyridine-3-carboxamide?
The IUPAC name of N-(1,3-benzodioxol-5-yl)-1-[(3-chlorophenyl)methoxy]-2-oxopyridine-3-carboxamide (CID 40505037) is N-(1,3-benzodioxol-5-yl)-1-[(3-chlorophenyl)methoxy]-2-oxopyridine-3-carboxamide.
What is the SMILES notation for N-(1,3-benzodioxol-5-yl)-1-[(3-chlorophenyl)methoxy]-2-oxopyridine-3-carboxamide?
The canonical SMILES for N-(1,3-benzodioxol-5-yl)-1-[(3-chlorophenyl)methoxy]-2-oxopyridine-3-carboxamide is O=C(Nc1ccc2c(c1)OCO2)c1cccn(OCc2cccc(Cl)c2)c1=O.
What is the InChIKey of N-(1,3-benzodioxol-5-yl)-1-[(3-chlorophenyl)methoxy]-2-oxopyridine-3-carboxamide?
The InChIKey is SEHFKEUIGULDSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15ClN2O5/c21-14-4-1-3-13(9-14)11-28-23-8-2-5-16(20(23)25)19(24)22-15-6-7-17-18(10-15)27-12-26-17/h1-10H,11-12H2,(H,22,24).
What are the key properties of N-(1,3-benzodioxol-5-yl)-1-[(3-chlorophenyl)methoxy]-2-oxopyridine-3-carboxamide?
N-(1,3-benzodioxol-5-yl)-1-[(3-chlorophenyl)methoxy]-2-oxopyridine-3-carboxamide has a molecular weight of 398.80 g/mol, XLogP of 3.11, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,3-benzodioxol-5-yl)-1-[(3-chlorophenyl)methoxy]-2-oxopyridine-3-carboxamide is sourced from PubChem (CID 40505037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).