2-hydroxy-4-methoxy-N-[4-[2-(methylamino)-2-oxoethyl]phenyl]benzamide

C17H18N2O4 — CID 38401851

IUPAC2-hydroxy-4-methoxy-N-[4-[2-(methylamino)-2-oxoethyl]phenyl]benzamide
SMILESCNC(=O)Cc1ccc(NC(=O)c2ccc(OC)cc2O)cc1
InChIInChI=1S/C17H18N2O4/c1-18-16(21)9-11-3-5-12(6-4-11)19-17(22)14-8-7-13(23-2)10-15(14)20/h3-8,10,20H,9H2,1-2H3,(H,18,21)(H,19,22)
InChIKeyDWPCLWODMHOGFI-UHFFFAOYSA-N
MW314.34 g/mol
LogP1.94
Rot. Bonds5

About 2-hydroxy-4-methoxy-N-[4-[2-(methylamino)-2-oxoethyl]phenyl]benzamide

2-hydroxy-4-methoxy-N-[4-[2-(methylamino)-2-oxoethyl]phenyl]benzamide (PubChem CID 38401851) has the molecular formula C17H18N2O4 and a molecular weight of 314.34 g/mol. Its IUPAC name is 2-hydroxy-4-methoxy-N-[4-[2-(methylamino)-2-oxoethyl]phenyl]benzamide.

Molecular Properties

Compound Name2-hydroxy-4-methoxy-N-[4-[2-(methylamino)-2-oxoethyl]phenyl]benzamide
PubChem CID38401851
Molecular FormulaC17H18N2O4
Molecular Weight314.34 g/mol
Exact Mass314.13
IUPAC Name2-hydroxy-4-methoxy-N-[4-[2-(methylamino)-2-oxoethyl]phenyl]benzamide
SMILESCNC(=O)Cc1ccc(NC(=O)c2ccc(OC)cc2O)cc1
InChIInChI=1S/C17H18N2O4/c1-18-16(21)9-11-3-5-12(6-4-11)19-17(22)14-8-7-13(23-2)10-15(14)20/h3-8,10,20H,9H2,1-2H3,(H,18,21)(H,19,22)
InChIKeyDWPCLWODMHOGFI-UHFFFAOYSA-N
XLogP1.94
TPSA87.66 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.34
LogP ≤ 51.94
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-hydroxy-N-[4-[(2-hydroxy-4-methoxybenzoyl)amino]phenyl]-4-methoxybenzamide
CID 23249025
2-fluoro-4-methoxy-N-[4-[2-(methylamino)-2-oxoethyl]phenyl]benzamide
CID 38403308
2-hydroxy-N-[4-(2-hydroxyethyl)phenyl]-4-methoxybenzamide
CID 61221954
2-hydroxy-4-methoxy-N-(4-methylsulfonylphenyl)benzamide
CID 155988762
2-hydroxy-4-methoxy-N-(3-methoxyphenyl)benzamide
CID 27167303
6-methoxy-N-[4-[2-(methylamino)-2-oxoethyl]phenyl]-1H-indole-2-carboxamide
CID 36545679
N-(4-ethylphenyl)-2-hydroxy-5-methoxybenzamide
CID 60716192
N-[3-(chloromethyl)phenyl]-2-hydroxy-4-methoxybenzamide
CID 114293188
2-hydroxy-4-methoxy-N-[3-(methylamino)-3-oxopropyl]benzamide
CID 47415526
2-hydroxy-4-[(4-methoxyphenyl)methoxy]-N-methylbenzamide
CID 68959972
N-(3-amino-4-bromophenyl)-2-hydroxy-4-methoxybenzamide
CID 79768120
N-(2,6-diethylphenyl)-2-hydroxy-4-methoxybenzamide
CID 43824721

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-4-methoxy-N-[4-[2-(methylamino)-2-oxoethyl]phenyl]benzamide?
The IUPAC name of 2-hydroxy-4-methoxy-N-[4-[2-(methylamino)-2-oxoethyl]phenyl]benzamide (CID 38401851) is 2-hydroxy-4-methoxy-N-[4-[2-(methylamino)-2-oxoethyl]phenyl]benzamide.
What is the SMILES notation for 2-hydroxy-4-methoxy-N-[4-[2-(methylamino)-2-oxoethyl]phenyl]benzamide?
The canonical SMILES for 2-hydroxy-4-methoxy-N-[4-[2-(methylamino)-2-oxoethyl]phenyl]benzamide is CNC(=O)Cc1ccc(NC(=O)c2ccc(OC)cc2O)cc1.
What is the InChIKey of 2-hydroxy-4-methoxy-N-[4-[2-(methylamino)-2-oxoethyl]phenyl]benzamide?
The InChIKey is DWPCLWODMHOGFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O4/c1-18-16(21)9-11-3-5-12(6-4-11)19-17(22)14-8-7-13(23-2)10-15(14)20/h3-8,10,20H,9H2,1-2H3,(H,18,21)(H,19,22).
What are the key properties of 2-hydroxy-4-methoxy-N-[4-[2-(methylamino)-2-oxoethyl]phenyl]benzamide?
2-hydroxy-4-methoxy-N-[4-[2-(methylamino)-2-oxoethyl]phenyl]benzamide has a molecular weight of 314.34 g/mol, XLogP of 1.94, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-4-methoxy-N-[4-[2-(methylamino)-2-oxoethyl]phenyl]benzamide is sourced from PubChem (CID 38401851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).