N-[[4-[2-(methylamino)-2-oxoethoxy]phenyl]methyl]-2-oxo-1H-pyridine-3-carboxamide

C16H17N3O4 — CID 56798194

IUPACN-[[4-[2-(methylamino)-2-oxoethoxy]phenyl]methyl]-2-oxo-1H-pyridine-3-carboxamide
SMILESCNC(=O)COc1ccc(CNC(=O)c2ccc[nH]c2=O)cc1
InChIInChI=1S/C16H17N3O4/c1-17-14(20)10-23-12-6-4-11(5-7-12)9-19-16(22)13-3-2-8-18-15(13)21/h2-8H,9-10H2,1H3,(H,17,20)(H,18,21)(H,19,22)
InChIKeySAACPSDACMTPCN-UHFFFAOYSA-N
MW315.33 g/mol
LogP0.43
Rot. Bonds6

About N-[[4-[2-(methylamino)-2-oxoethoxy]phenyl]methyl]-2-oxo-1H-pyridine-3-carboxamide

N-[[4-[2-(methylamino)-2-oxoethoxy]phenyl]methyl]-2-oxo-1H-pyridine-3-carboxamide (PubChem CID 56798194) has the molecular formula C16H17N3O4 and a molecular weight of 315.33 g/mol. Its IUPAC name is N-[[4-[2-(methylamino)-2-oxoethoxy]phenyl]methyl]-2-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[[4-[2-(methylamino)-2-oxoethoxy]phenyl]methyl]-2-oxo-1H-pyridine-3-carboxamide
PubChem CID56798194
Molecular FormulaC16H17N3O4
Molecular Weight315.33 g/mol
Exact Mass315.12
IUPAC NameN-[[4-[2-(methylamino)-2-oxoethoxy]phenyl]methyl]-2-oxo-1H-pyridine-3-carboxamide
SMILESCNC(=O)COc1ccc(CNC(=O)c2ccc[nH]c2=O)cc1
InChIInChI=1S/C16H17N3O4/c1-17-14(20)10-23-12-6-4-11(5-7-12)9-19-16(22)13-3-2-8-18-15(13)21/h2-8H,9-10H2,1H3,(H,17,20)(H,18,21)(H,19,22)
InChIKeySAACPSDACMTPCN-UHFFFAOYSA-N
XLogP0.43
TPSA100.29 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.33
LogP ≤ 50.43
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(4-ethoxyphenyl)methyl]-2-oxo-1H-pyridine-3-carboxamide
CID 46858927
N-[[4-(cyanomethoxy)phenyl]methyl]-2-oxo-1H-pyridine-3-carboxamide
CID 126810317
N-[[4-[2-(methylamino)-2-oxoethoxy]phenyl]methyl]-2-(trifluoromethyl)benzamide
CID 47064047
N-[(4-methoxyphenyl)methyl]-2-[2-(methylamino)-2-oxoethoxy]benzamide
CID 38113686
N-[[4-(diethylaminomethyl)phenyl]methyl]-2-oxo-1H-pyridine-3-carboxamide
CID 31610697
2-oxo-N-[[4-[[(2S)-oxolan-2-yl]methoxy]phenyl]methyl]-1H-pyridine-3-carboxamide
CID 51949056
N-[[4-(butanoylamino)phenyl]methyl]-2-oxo-1H-pyridine-3-carboxamide
CID 60516002
N-[[4-[2-(methylamino)-2-oxoethoxy]phenyl]methyl]-2-oxochromene-3-carboxamide
CID 51121667
2-[[2-(4-methylphenoxy)acetyl]amino]-N-[(4-methylphenyl)methyl]benzamide
CID 52891720
2-oxo-N-[[4-(2,2,2-trifluoroethoxymethyl)phenyl]methyl]-1H-pyridine-3-carboxamide
CID 24599022
N-[3-(methylamino)propyl]-2-oxo-1H-pyridine-3-carboxamide
CID 43600703
2-[[2-(4-fluorophenoxy)acetyl]amino]-N-[(4-methylphenyl)methyl]benzamide
CID 55327835

Frequently Asked Questions

What is the IUPAC name of N-[[4-[2-(methylamino)-2-oxoethoxy]phenyl]methyl]-2-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-[[4-[2-(methylamino)-2-oxoethoxy]phenyl]methyl]-2-oxo-1H-pyridine-3-carboxamide (CID 56798194) is N-[[4-[2-(methylamino)-2-oxoethoxy]phenyl]methyl]-2-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-[[4-[2-(methylamino)-2-oxoethoxy]phenyl]methyl]-2-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-[[4-[2-(methylamino)-2-oxoethoxy]phenyl]methyl]-2-oxo-1H-pyridine-3-carboxamide is CNC(=O)COc1ccc(CNC(=O)c2ccc[nH]c2=O)cc1.
What is the InChIKey of N-[[4-[2-(methylamino)-2-oxoethoxy]phenyl]methyl]-2-oxo-1H-pyridine-3-carboxamide?
The InChIKey is SAACPSDACMTPCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O4/c1-17-14(20)10-23-12-6-4-11(5-7-12)9-19-16(22)13-3-2-8-18-15(13)21/h2-8H,9-10H2,1H3,(H,17,20)(H,18,21)(H,19,22).
What are the key properties of N-[[4-[2-(methylamino)-2-oxoethoxy]phenyl]methyl]-2-oxo-1H-pyridine-3-carboxamide?
N-[[4-[2-(methylamino)-2-oxoethoxy]phenyl]methyl]-2-oxo-1H-pyridine-3-carboxamide has a molecular weight of 315.33 g/mol, XLogP of 0.43, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-[2-(methylamino)-2-oxoethoxy]phenyl]methyl]-2-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 56798194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).