N-[2-(2-methoxy-5-methylanilino)-2-oxoethyl]benzamide

C17H18N2O3 — CID 9215526

IUPACN-[2-(2-methoxy-5-methylanilino)-2-oxoethyl]benzamide
SMILESCOc1ccc(C)cc1NC(=O)CNC(=O)c1ccccc1
InChIInChI=1S/C17H18N2O3/c1-12-8-9-15(22-2)14(10-12)19-16(20)11-18-17(21)13-6-4-3-5-7-13/h3-10H,11H2,1-2H3,(H,18,21)(H,19,20)
InChIKeyKPILWDPWFIRYKS-UHFFFAOYSA-N
MW298.34 g/mol
LogP2.37
Rot. Bonds5

About N-[2-(2-methoxy-5-methylanilino)-2-oxoethyl]benzamide

N-[2-(2-methoxy-5-methylanilino)-2-oxoethyl]benzamide (PubChem CID 9215526) has the molecular formula C17H18N2O3 and a molecular weight of 298.34 g/mol. Its IUPAC name is N-[2-(2-methoxy-5-methylanilino)-2-oxoethyl]benzamide.

Molecular Properties

Compound NameN-[2-(2-methoxy-5-methylanilino)-2-oxoethyl]benzamide
PubChem CID9215526
Molecular FormulaC17H18N2O3
Molecular Weight298.34 g/mol
Exact Mass298.13
IUPAC NameN-[2-(2-methoxy-5-methylanilino)-2-oxoethyl]benzamide
SMILESCOc1ccc(C)cc1NC(=O)CNC(=O)c1ccccc1
InChIInChI=1S/C17H18N2O3/c1-12-8-9-15(22-2)14(10-12)19-16(20)11-18-17(21)13-6-4-3-5-7-13/h3-10H,11H2,1-2H3,(H,18,21)(H,19,20)
InChIKeyKPILWDPWFIRYKS-UHFFFAOYSA-N
XLogP2.37
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.34
LogP ≤ 52.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(2-methoxy-5-methylanilino)-2-oxoethyl]-4-(phenylcarbamoylamino)benzamide
CID 46551082
N-[3-(2-methoxy-5-methylanilino)-3-oxopropyl]benzamide
CID 9098271
N-[2-(2-methoxy-5-methylanilino)-2-oxoethyl]-3-phenylmethoxybenzamide
CID 46551015
N-[2-(2-methoxy-5-methylanilino)-2-oxoethyl]-2-methylbenzamide
CID 28917301
N-[2-(2,5-dimethoxy-4-methylanilino)-2-oxoethyl]benzamide
CID 110792956
3-bromo-4-methoxy-N-[2-(2-methoxy-5-methylanilino)-2-oxoethyl]benzamide
CID 24673626
N-[2-[4-methoxy-3-[(2-methoxyacetyl)amino]anilino]-2-oxoethyl]benzamide
CID 131925236
N-[2-(2,5-dimethoxyanilino)-2-oxoethyl]-3-methylbenzamide
CID 3503389
2-(benzylcarbamoylamino)-N-(2-methoxy-5-methylphenyl)acetamide
CID 24559532
1-N-benzyl-4-N-(2-methoxy-5-methylphenyl)benzene-1,4-dicarboxamide
CID 109046739
N-[2-[2-(2-methoxy-5-methylphenyl)ethylamino]-2-oxoethyl]benzamide
CID 41309387
N-[2-(5-acetamido-2-methoxyanilino)-2-oxoethyl]-4-phenylbenzamide
CID 37013397

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-methoxy-5-methylanilino)-2-oxoethyl]benzamide?
The IUPAC name of N-[2-(2-methoxy-5-methylanilino)-2-oxoethyl]benzamide (CID 9215526) is N-[2-(2-methoxy-5-methylanilino)-2-oxoethyl]benzamide.
What is the SMILES notation for N-[2-(2-methoxy-5-methylanilino)-2-oxoethyl]benzamide?
The canonical SMILES for N-[2-(2-methoxy-5-methylanilino)-2-oxoethyl]benzamide is COc1ccc(C)cc1NC(=O)CNC(=O)c1ccccc1.
What is the InChIKey of N-[2-(2-methoxy-5-methylanilino)-2-oxoethyl]benzamide?
The InChIKey is KPILWDPWFIRYKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O3/c1-12-8-9-15(22-2)14(10-12)19-16(20)11-18-17(21)13-6-4-3-5-7-13/h3-10H,11H2,1-2H3,(H,18,21)(H,19,20).
What are the key properties of N-[2-(2-methoxy-5-methylanilino)-2-oxoethyl]benzamide?
N-[2-(2-methoxy-5-methylanilino)-2-oxoethyl]benzamide has a molecular weight of 298.34 g/mol, XLogP of 2.37, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-methoxy-5-methylanilino)-2-oxoethyl]benzamide is sourced from PubChem (CID 9215526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).