5-methoxy-N-[2-(4-methoxyphenyl)ethyl]-1-methyl-4-oxopyridine-2-carboxamide

C17H20N2O4 — CID 71691870

IUPAC5-methoxy-N-[2-(4-methoxyphenyl)ethyl]-1-methyl-4-oxopyridine-2-carboxamide
SMILESCOc1ccc(CCNC(=O)c2cc(=O)c(OC)cn2C)cc1
InChIInChI=1S/C17H20N2O4/c1-19-11-16(23-3)15(20)10-14(19)17(21)18-9-8-12-4-6-13(22-2)7-5-12/h4-7,10-11H,8-9H2,1-3H3,(H,18,21)
InChIKeyNSSAXXYCIBJDGZ-UHFFFAOYSA-N
MW316.36 g/mol
LogP1.38
Rot. Bonds6

About 5-methoxy-N-[2-(4-methoxyphenyl)ethyl]-1-methyl-4-oxopyridine-2-carboxamide

5-methoxy-N-[2-(4-methoxyphenyl)ethyl]-1-methyl-4-oxopyridine-2-carboxamide (PubChem CID 71691870) has the molecular formula C17H20N2O4 and a molecular weight of 316.36 g/mol. Its IUPAC name is 5-methoxy-N-[2-(4-methoxyphenyl)ethyl]-1-methyl-4-oxopyridine-2-carboxamide.

Molecular Properties

Compound Name5-methoxy-N-[2-(4-methoxyphenyl)ethyl]-1-methyl-4-oxopyridine-2-carboxamide
PubChem CID71691870
Molecular FormulaC17H20N2O4
Molecular Weight316.36 g/mol
Exact Mass316.14
IUPAC Name5-methoxy-N-[2-(4-methoxyphenyl)ethyl]-1-methyl-4-oxopyridine-2-carboxamide
SMILESCOc1ccc(CCNC(=O)c2cc(=O)c(OC)cn2C)cc1
InChIInChI=1S/C17H20N2O4/c1-19-11-16(23-3)15(20)10-14(19)17(21)18-9-8-12-4-6-13(22-2)7-5-12/h4-7,10-11H,8-9H2,1-3H3,(H,18,21)
InChIKeyNSSAXXYCIBJDGZ-UHFFFAOYSA-N
XLogP1.38
TPSA69.56 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.36
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(4-fluorophenyl)methyl]-5-methoxy-1-methyl-4-oxopyridine-2-carboxamide
CID 53369192
4-bromo-N-[2-(3,4-dimethoxyphenyl)ethyl]-1-methylpyrrole-2-carboxamide
CID 86911932
2,5-dimethoxy-N-[2-(4-methoxyphenyl)ethyl]benzamide
CID 18189798
N-[(2-fluorophenyl)methyl]-5-methoxy-1-methyl-4-oxopyridine-2-carboxamide
CID 75489414
N-[2-(4-methoxyphenyl)ethyl]-2,4,5-trimethylbenzamide
CID 100708090
N-[2-(4-methoxyphenyl)ethyl]-2-(2,4,5-trimethoxyphenyl)acetamide
CID 134090189
5-methoxy-1-methyl-4-oxo-N-(4-phenoxyphenyl)pyridine-2-carboxamide
CID 51054204
1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[2-(4-methoxyphenyl)ethyl]urea
CID 51290944
N-[2-(3,4-dimethoxyphenyl)ethyl]-1,3-bis(4-methoxyphenyl)pyrazole-5-carboxamide
CID 5224331
2,3-dimethoxy-N-[2-(4-methoxyphenyl)ethyl]benzamide
CID 35509323
3-(2,5-dimethoxyphenyl)-N-[2-(4-fluorophenyl)ethyl]-1-methylpyrazole-5-carboxamide
CID 121084117
N-[3-(4-methoxyphenyl)propyl]-1-methyl-6-oxopyridine-3-carboxamide
CID 77089921

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-N-[2-(4-methoxyphenyl)ethyl]-1-methyl-4-oxopyridine-2-carboxamide?
The IUPAC name of 5-methoxy-N-[2-(4-methoxyphenyl)ethyl]-1-methyl-4-oxopyridine-2-carboxamide (CID 71691870) is 5-methoxy-N-[2-(4-methoxyphenyl)ethyl]-1-methyl-4-oxopyridine-2-carboxamide.
What is the SMILES notation for 5-methoxy-N-[2-(4-methoxyphenyl)ethyl]-1-methyl-4-oxopyridine-2-carboxamide?
The canonical SMILES for 5-methoxy-N-[2-(4-methoxyphenyl)ethyl]-1-methyl-4-oxopyridine-2-carboxamide is COc1ccc(CCNC(=O)c2cc(=O)c(OC)cn2C)cc1.
What is the InChIKey of 5-methoxy-N-[2-(4-methoxyphenyl)ethyl]-1-methyl-4-oxopyridine-2-carboxamide?
The InChIKey is NSSAXXYCIBJDGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O4/c1-19-11-16(23-3)15(20)10-14(19)17(21)18-9-8-12-4-6-13(22-2)7-5-12/h4-7,10-11H,8-9H2,1-3H3,(H,18,21).
What are the key properties of 5-methoxy-N-[2-(4-methoxyphenyl)ethyl]-1-methyl-4-oxopyridine-2-carboxamide?
5-methoxy-N-[2-(4-methoxyphenyl)ethyl]-1-methyl-4-oxopyridine-2-carboxamide has a molecular weight of 316.36 g/mol, XLogP of 1.38, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-N-[2-(4-methoxyphenyl)ethyl]-1-methyl-4-oxopyridine-2-carboxamide is sourced from PubChem (CID 71691870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).