N-[1-[(4-chlorophenyl)methyl]-5-methyl-2-oxo-3-pyridinyl]-2-methoxybenzamide

C21H19ClN2O3 — CID 3231731

IUPACN-[1-[(4-chlorophenyl)methyl]-5-methyl-2-oxo-3-pyridinyl]-2-methoxybenzamide
SMILESCOc1ccccc1C(=O)Nc1cc(C)cn(Cc2ccc(Cl)cc2)c1=O
InChIInChI=1S/C21H19ClN2O3/c1-14-11-18(23-20(25)17-5-3-4-6-19(17)27-2)21(26)24(12-14)13-15-7-9-16(22)10-8-15/h3-12H,13H2,1-2H3,(H,23,25)
InChIKeyDDEJDLJBNWWRCJ-UHFFFAOYSA-N
MW382.85 g/mol
LogP4.12
Rot. Bonds5

About N-[1-[(4-chlorophenyl)methyl]-5-methyl-2-oxo-3-pyridinyl]-2-methoxybenzamide

N-[1-[(4-chlorophenyl)methyl]-5-methyl-2-oxo-3-pyridinyl]-2-methoxybenzamide (PubChem CID 3231731) has the molecular formula C21H19ClN2O3 and a molecular weight of 382.85 g/mol. Its IUPAC name is N-[1-[(4-chlorophenyl)methyl]-5-methyl-2-oxo-3-pyridinyl]-2-methoxybenzamide.

Molecular Properties

Compound NameN-[1-[(4-chlorophenyl)methyl]-5-methyl-2-oxo-3-pyridinyl]-2-methoxybenzamide
PubChem CID3231731
Molecular FormulaC21H19ClN2O3
Molecular Weight382.85 g/mol
Exact Mass382.11
IUPAC NameN-[1-[(4-chlorophenyl)methyl]-5-methyl-2-oxo-3-pyridinyl]-2-methoxybenzamide
SMILESCOc1ccccc1C(=O)Nc1cc(C)cn(Cc2ccc(Cl)cc2)c1=O
InChIInChI=1S/C21H19ClN2O3/c1-14-11-18(23-20(25)17-5-3-4-6-19(17)27-2)21(26)24(12-14)13-15-7-9-16(22)10-8-15/h3-12H,13H2,1-2H3,(H,23,25)
InChIKeyDDEJDLJBNWWRCJ-UHFFFAOYSA-N
XLogP4.12
TPSA60.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.85
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[(4-chlorophenyl)methyl]-N-(2,5-dimethoxyphenyl)-2-oxopyridine-3-carboxamide
CID 7598073
N-(5-chloro-2-fluorophenyl)-2-methoxybenzamide
CID 8759235
N-(2,4-dichlorophenyl)-2-methoxybenzamide
CID 814241
1-[1-[(3-fluorophenyl)methyl]-5-methyl-2-oxo-3-pyridinyl]-3-(2-methoxyphenyl)urea
CID 3231748
1-[(4-chlorophenyl)methyl]-N-(3,4-dimethoxyphenyl)-2-oxopyridine-3-carboxamide
CID 1483550
N-[1-[(4-fluorophenyl)methyl]-5-methyl-2-oxo-3-pyridinyl]-2-methoxyacetamide
CID 6488633
1-[(4-chlorophenyl)methyl]-N-(2-methoxy-5-methylphenyl)-2-oxo-1,8-naphthyridine-3-carboxamide
CID 43996326
N-(1-benzyl-5-methyl-2-oxo-3-pyridinyl)thiophene-2-carboxamide
CID 3231706
N-(4-chloro-2-pyrrol-1-ylphenyl)-2-methoxybenzamide
CID 56530750
N-(2-methoxy-5-methylphenyl)-1-[(4-methylphenyl)methyl]-6-oxopyridine-3-carboxamide
CID 8697109
N-(1-butyl-5,6-dimethyl-2-oxo-3-pyridinyl)-2-methoxybenzamide
CID 23587986
1-[(4-chlorophenyl)methyl]-N-[(Z)-(2-methoxyphenyl)methylideneamino]-2-oxopyridine-3-carboxamide
CID 110524114

Frequently Asked Questions

What is the IUPAC name of N-[1-[(4-chlorophenyl)methyl]-5-methyl-2-oxo-3-pyridinyl]-2-methoxybenzamide?
The IUPAC name of N-[1-[(4-chlorophenyl)methyl]-5-methyl-2-oxo-3-pyridinyl]-2-methoxybenzamide (CID 3231731) is N-[1-[(4-chlorophenyl)methyl]-5-methyl-2-oxo-3-pyridinyl]-2-methoxybenzamide.
What is the SMILES notation for N-[1-[(4-chlorophenyl)methyl]-5-methyl-2-oxo-3-pyridinyl]-2-methoxybenzamide?
The canonical SMILES for N-[1-[(4-chlorophenyl)methyl]-5-methyl-2-oxo-3-pyridinyl]-2-methoxybenzamide is COc1ccccc1C(=O)Nc1cc(C)cn(Cc2ccc(Cl)cc2)c1=O.
What is the InChIKey of N-[1-[(4-chlorophenyl)methyl]-5-methyl-2-oxo-3-pyridinyl]-2-methoxybenzamide?
The InChIKey is DDEJDLJBNWWRCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19ClN2O3/c1-14-11-18(23-20(25)17-5-3-4-6-19(17)27-2)21(26)24(12-14)13-15-7-9-16(22)10-8-15/h3-12H,13H2,1-2H3,(H,23,25).
What are the key properties of N-[1-[(4-chlorophenyl)methyl]-5-methyl-2-oxo-3-pyridinyl]-2-methoxybenzamide?
N-[1-[(4-chlorophenyl)methyl]-5-methyl-2-oxo-3-pyridinyl]-2-methoxybenzamide has a molecular weight of 382.85 g/mol, XLogP of 4.12, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[(4-chlorophenyl)methyl]-5-methyl-2-oxo-3-pyridinyl]-2-methoxybenzamide is sourced from PubChem (CID 3231731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).