N-benzyl-N'-(2-methoxy-5-methylphenyl)oxamide

C17H18N2O3 — CID 2060862

IUPACN-benzyl-N'-(2-methoxy-5-methylphenyl)oxamide
SMILESCOc1ccc(C)cc1NC(=O)C(=O)NCc1ccccc1
InChIInChI=1S/C17H18N2O3/c1-12-8-9-15(22-2)14(10-12)19-17(21)16(20)18-11-13-6-4-3-5-7-13/h3-10H,11H2,1-2H3,(H,18,20)(H,19,21)
InChIKeyMTMZJSMNELDDRX-UHFFFAOYSA-N
MW298.34 g/mol
LogP2.26
Rot. Bonds4

About N-benzyl-N'-(2-methoxy-5-methylphenyl)oxamide

N-benzyl-N'-(2-methoxy-5-methylphenyl)oxamide (PubChem CID 2060862) has the molecular formula C17H18N2O3 and a molecular weight of 298.34 g/mol. Its IUPAC name is N-benzyl-N'-(2-methoxy-5-methylphenyl)oxamide.

Molecular Properties

Compound NameN-benzyl-N'-(2-methoxy-5-methylphenyl)oxamide
PubChem CID2060862
Molecular FormulaC17H18N2O3
Molecular Weight298.34 g/mol
Exact Mass298.13
IUPAC NameN-benzyl-N'-(2-methoxy-5-methylphenyl)oxamide
SMILESCOc1ccc(C)cc1NC(=O)C(=O)NCc1ccccc1
InChIInChI=1S/C17H18N2O3/c1-12-8-9-15(22-2)14(10-12)19-17(21)16(20)18-11-13-6-4-3-5-7-13/h3-10H,11H2,1-2H3,(H,18,20)(H,19,21)
InChIKeyMTMZJSMNELDDRX-UHFFFAOYSA-N
XLogP2.26
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.34
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Related Compounds

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CID 90303
Acetamide, N-(2-methoxy-5-methylphenyl)-
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4-fluoro-N-(2-(4-(2-methoxyphenyl)piperazin-1-yl)ethyl)benzamide
CID 13318472
N-(2-methoxy-5-methylphenyl)-2-phenylcyclopropane-1-carboxamide
CID 2862625
6-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)hexanamide
CID 11432177
5-(4-Methoxybiphenyl-3-YL)-1,2,5-thiadiazolidin-3-one 1,1-dioxide
CID 4369451
2-(4-methylpiperazino)-N-(2-phenoxyphenyl)acetamide
CID 2813152
2-Methoxyfentanyl
CID 12741853
2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(3-methylphenyl)acetamide
CID 2653640
N-{4-[4-(2-Methoxy-phenyl)-piperazin-1-yl]-butyl}-2,2-dimethyl-propionamide
CID 9863108
N-[2-(N-benzyl-3-methoxyanilino)ethyl]acetamide
CID 24750069

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N'-(2-methoxy-5-methylphenyl)oxamide?
The IUPAC name of N-benzyl-N'-(2-methoxy-5-methylphenyl)oxamide (CID 2060862) is N-benzyl-N'-(2-methoxy-5-methylphenyl)oxamide.
What is the SMILES notation for N-benzyl-N'-(2-methoxy-5-methylphenyl)oxamide?
The canonical SMILES for N-benzyl-N'-(2-methoxy-5-methylphenyl)oxamide is COc1ccc(C)cc1NC(=O)C(=O)NCc1ccccc1.
What is the InChIKey of N-benzyl-N'-(2-methoxy-5-methylphenyl)oxamide?
The InChIKey is MTMZJSMNELDDRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O3/c1-12-8-9-15(22-2)14(10-12)19-17(21)16(20)18-11-13-6-4-3-5-7-13/h3-10H,11H2,1-2H3,(H,18,20)(H,19,21).
What are the key properties of N-benzyl-N'-(2-methoxy-5-methylphenyl)oxamide?
N-benzyl-N'-(2-methoxy-5-methylphenyl)oxamide has a molecular weight of 298.34 g/mol, XLogP of 2.26, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N'-(2-methoxy-5-methylphenyl)oxamide is sourced from PubChem (CID 2060862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).