N-[(1S,2S)-2-(4-methoxyphenyl)cyclopropyl]-N'-(2-methylphenyl)oxamide

C19H20N2O3 — CID 95300072

IUPACN-[(1S,2S)-2-(4-methoxyphenyl)cyclopropyl]-N'-(2-methylphenyl)oxamide
SMILESCOc1ccc([C@@H]2C[C@@H]2NC(=O)C(=O)Nc2ccccc2C)cc1
InChIInChI=1S/C19H20N2O3/c1-12-5-3-4-6-16(12)20-18(22)19(23)21-17-11-15(17)13-7-9-14(24-2)10-8-13/h3-10,15,17H,11H2,1-2H3,(H,20,22)(H,21,23)/t15-,17-/m0/s1
InChIKeyRVBFNARMDJUHIS-RDJZCZTQSA-N
MW324.38 g/mol
LogP2.61
Rot. Bonds4

About N-[(1S,2S)-2-(4-methoxyphenyl)cyclopropyl]-N'-(2-methylphenyl)oxamide

N-[(1S,2S)-2-(4-methoxyphenyl)cyclopropyl]-N'-(2-methylphenyl)oxamide (PubChem CID 95300072) has the molecular formula C19H20N2O3 and a molecular weight of 324.38 g/mol. Its IUPAC name is N-[(1S,2S)-2-(4-methoxyphenyl)cyclopropyl]-N'-(2-methylphenyl)oxamide.

Molecular Properties

Compound NameN-[(1S,2S)-2-(4-methoxyphenyl)cyclopropyl]-N'-(2-methylphenyl)oxamide
PubChem CID95300072
Molecular FormulaC19H20N2O3
Molecular Weight324.38 g/mol
Exact Mass324.15
IUPAC NameN-[(1S,2S)-2-(4-methoxyphenyl)cyclopropyl]-N'-(2-methylphenyl)oxamide
SMILESCOc1ccc([C@@H]2C[C@@H]2NC(=O)C(=O)Nc2ccccc2C)cc1
InChIInChI=1S/C19H20N2O3/c1-12-5-3-4-6-16(12)20-18(22)19(23)21-17-11-15(17)13-7-9-14(24-2)10-8-13/h3-10,15,17H,11H2,1-2H3,(H,20,22)(H,21,23)/t15-,17-/m0/s1
InChIKeyRVBFNARMDJUHIS-RDJZCZTQSA-N
XLogP2.61
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.38
LogP ≤ 52.61
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

N'-(4-fluoro-2-methylphenyl)-N-[(1S,2R)-2-(4-methoxyphenyl)cyclopropyl]oxamide
CID 95160458
2-N-(4-methoxyphenyl)-1-N-(2-methylphenyl)cyclopropane-1,2-dicarboxamide
CID 109140939
methyl 2-oxo-2-[(2-phenylcyclopropyl)amino]acetate
CID 112617050
(6R)-6-(4-methoxyphenyl)-3,4-dimethyl-N-(2-methylphenyl)-2-oxo-1,6-dihydropyrimidine-5-carboxamide
CID 1000116
N-cyclopentyl-N'-(2-methylphenyl)oxamide
CID 2290931
4-(4-methoxyphenyl)-6-methyl-N-(2-methylphenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide
CID 2849941
N'-(2,3-dimethylphenyl)-N-(4-methoxyphenyl)oxamide
CID 44995875
N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl]-N'-(2-methylphenyl)oxamide
CID 42390414
N-[2-(2-chlorophenyl)cyclopropyl]-2-(4-methoxyphenyl)cyclopropane-1-carboxamide
CID 71880321
3-(4-methoxyphenyl)-N-(2-methylphenyl)prop-2-enamide
CID 5036068
(4R)-N-[(1R,2S)-2-(4-methoxyphenyl)cyclopropyl]-2-oxoimidazolidine-4-carboxamide
CID 124856857
N-(4-iodo-2-methylphenyl)-2-(4-methoxyphenyl)cyclopropane-1-carboxamide
CID 84569194

Frequently Asked Questions

What is the IUPAC name of N-[(1S,2S)-2-(4-methoxyphenyl)cyclopropyl]-N'-(2-methylphenyl)oxamide?
The IUPAC name of N-[(1S,2S)-2-(4-methoxyphenyl)cyclopropyl]-N'-(2-methylphenyl)oxamide (CID 95300072) is N-[(1S,2S)-2-(4-methoxyphenyl)cyclopropyl]-N'-(2-methylphenyl)oxamide.
What is the SMILES notation for N-[(1S,2S)-2-(4-methoxyphenyl)cyclopropyl]-N'-(2-methylphenyl)oxamide?
The canonical SMILES for N-[(1S,2S)-2-(4-methoxyphenyl)cyclopropyl]-N'-(2-methylphenyl)oxamide is COc1ccc([C@@H]2C[C@@H]2NC(=O)C(=O)Nc2ccccc2C)cc1.
What is the InChIKey of N-[(1S,2S)-2-(4-methoxyphenyl)cyclopropyl]-N'-(2-methylphenyl)oxamide?
The InChIKey is RVBFNARMDJUHIS-RDJZCZTQSA-N. The full InChI is InChI=1S/C19H20N2O3/c1-12-5-3-4-6-16(12)20-18(22)19(23)21-17-11-15(17)13-7-9-14(24-2)10-8-13/h3-10,15,17H,11H2,1-2H3,(H,20,22)(H,21,23)/t15-,17-/m0/s1.
What are the key properties of N-[(1S,2S)-2-(4-methoxyphenyl)cyclopropyl]-N'-(2-methylphenyl)oxamide?
N-[(1S,2S)-2-(4-methoxyphenyl)cyclopropyl]-N'-(2-methylphenyl)oxamide has a molecular weight of 324.38 g/mol, XLogP of 2.61, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S,2S)-2-(4-methoxyphenyl)cyclopropyl]-N'-(2-methylphenyl)oxamide is sourced from PubChem (CID 95300072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).