N-(4-acetamidophenyl)-2,3-dimethoxybenzamide

C17H18N2O4 — CID 912418

IUPACN-(4-acetamidophenyl)-2,3-dimethoxybenzamide
SMILESCOc1cccc(C(=O)Nc2ccc(NC(C)=O)cc2)c1OC
InChIInChI=1S/C17H18N2O4/c1-11(20)18-12-7-9-13(10-8-12)19-17(21)14-5-4-6-15(22-2)16(14)23-3/h4-10H,1-3H3,(H,18,20)(H,19,21)
InChIKeyPRBQXUJEHOQDNY-UHFFFAOYSA-N
MW314.34 g/mol
LogP2.91
Rot. Bonds5

About N-(4-acetamidophenyl)-2,3-dimethoxybenzamide

N-(4-acetamidophenyl)-2,3-dimethoxybenzamide (PubChem CID 912418) has the molecular formula C17H18N2O4 and a molecular weight of 314.34 g/mol. Its IUPAC name is N-(4-acetamidophenyl)-2,3-dimethoxybenzamide.

Molecular Properties

Compound NameN-(4-acetamidophenyl)-2,3-dimethoxybenzamide
PubChem CID912418
Molecular FormulaC17H18N2O4
Molecular Weight314.34 g/mol
Exact Mass314.13
IUPAC NameN-(4-acetamidophenyl)-2,3-dimethoxybenzamide
SMILESCOc1cccc(C(=O)Nc2ccc(NC(C)=O)cc2)c1OC
InChIInChI=1S/C17H18N2O4/c1-11(20)18-12-7-9-13(10-8-12)19-17(21)14-5-4-6-15(22-2)16(14)23-3/h4-10H,1-3H3,(H,18,20)(H,19,21)
InChIKeyPRBQXUJEHOQDNY-UHFFFAOYSA-N
XLogP2.91
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.34
LogP ≤ 52.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2,3-dimethoxy-N-(4-phenoxyphenyl)benzamide
CID 912370
2,3-dimethoxy-N-[4-(trifluoromethoxy)phenyl]benzamide
CID 24641310
2-[4-[(2,3-dimethoxybenzoyl)amino]phenyl]-2-methylpropanoic acid
CID 119253872
2,3-dimethoxy-N-(3-methoxyphenyl)benzamide
CID 912443
N-(4-acetamidophenyl)-2,4-dimethoxy-3-methylbenzamide
CID 110763407
2,3-dimethoxy-N-(4-phenylmethoxyphenyl)benzamide
CID 27650117
2,3-dimethoxy-N-(4-morpholin-4-ylphenyl)benzamide
CID 26269457
2,3-dimethoxy-N-[4-(2,2,2-trifluoroethoxy)phenyl]benzamide
CID 55474623
N-(2,3-dihydro-1H-inden-5-yl)-2,3-dimethoxybenzamide
CID 26198866
N-(9,10-dioxoanthracen-2-yl)-2,3-dimethoxybenzamide
CID 7533072
N-(4-cyclopentylsulfanylphenyl)-2,3-dimethoxybenzamide
CID 37400540
N-[4-(3-acetamidoanilino)phenyl]-2-methoxybenzamide
CID 112988294

Frequently Asked Questions

What is the IUPAC name of N-(4-acetamidophenyl)-2,3-dimethoxybenzamide?
The IUPAC name of N-(4-acetamidophenyl)-2,3-dimethoxybenzamide (CID 912418) is N-(4-acetamidophenyl)-2,3-dimethoxybenzamide.
What is the SMILES notation for N-(4-acetamidophenyl)-2,3-dimethoxybenzamide?
The canonical SMILES for N-(4-acetamidophenyl)-2,3-dimethoxybenzamide is COc1cccc(C(=O)Nc2ccc(NC(C)=O)cc2)c1OC.
What is the InChIKey of N-(4-acetamidophenyl)-2,3-dimethoxybenzamide?
The InChIKey is PRBQXUJEHOQDNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O4/c1-11(20)18-12-7-9-13(10-8-12)19-17(21)14-5-4-6-15(22-2)16(14)23-3/h4-10H,1-3H3,(H,18,20)(H,19,21).
What are the key properties of N-(4-acetamidophenyl)-2,3-dimethoxybenzamide?
N-(4-acetamidophenyl)-2,3-dimethoxybenzamide has a molecular weight of 314.34 g/mol, XLogP of 2.91, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetamidophenyl)-2,3-dimethoxybenzamide is sourced from PubChem (CID 912418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).