N'-[(1R)-2-methyl-1-phenylpropyl]-N-[(1R)-1-phenylpropyl]oxamide

C21H26N2O2 — CID 124846210

IUPACN'-[(1R)-2-methyl-1-phenylpropyl]-N-[(1R)-1-phenylpropyl]oxamide
SMILESCC[C@@H](NC(=O)C(=O)N[C@@H](c1ccccc1)C(C)C)c1ccccc1
InChIInChI=1S/C21H26N2O2/c1-4-18(16-11-7-5-8-12-16)22-20(24)21(25)23-19(15(2)3)17-13-9-6-10-14-17/h5-15,18-19H,4H2,1-3H3,(H,22,24)(H,23,25)/t18-,19-/m1/s1
InChIKeyIIXPALUCZKQOBF-RTBURBONSA-N
MW338.45 g/mol
LogP3.77
Rot. Bonds6

About N'-[(1R)-2-methyl-1-phenylpropyl]-N-[(1R)-1-phenylpropyl]oxamide

N'-[(1R)-2-methyl-1-phenylpropyl]-N-[(1R)-1-phenylpropyl]oxamide (PubChem CID 124846210) has the molecular formula C21H26N2O2 and a molecular weight of 338.45 g/mol. Its IUPAC name is N'-[(1R)-2-methyl-1-phenylpropyl]-N-[(1R)-1-phenylpropyl]oxamide.

Molecular Properties

Compound NameN'-[(1R)-2-methyl-1-phenylpropyl]-N-[(1R)-1-phenylpropyl]oxamide
PubChem CID124846210
Molecular FormulaC21H26N2O2
Molecular Weight338.45 g/mol
Exact Mass338.20
IUPAC NameN'-[(1R)-2-methyl-1-phenylpropyl]-N-[(1R)-1-phenylpropyl]oxamide
SMILESCC[C@@H](NC(=O)C(=O)N[C@@H](c1ccccc1)C(C)C)c1ccccc1
InChIInChI=1S/C21H26N2O2/c1-4-18(16-11-7-5-8-12-16)22-20(24)21(25)23-19(15(2)3)17-13-9-6-10-14-17/h5-15,18-19H,4H2,1-3H3,(H,22,24)(H,23,25)/t18-,19-/m1/s1
InChIKeyIIXPALUCZKQOBF-RTBURBONSA-N
XLogP3.77
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.45
LogP ≤ 53.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(2-aminoethyl)-N'-(1-phenylpropyl)oxamide
CID 62304180
2-[(2-methyl-1-phenylpropyl)amino]butanoic acid
CID 113292394
2-bromo-N-[(1R)-1-phenylpropyl]propanamide
CID 165438304
1-N,4-N-bis(1-phenylpropyl)benzene-1,4-dicarboxamide
CID 43912072
(2S)-2-(methylamino)-N-(1-phenylpropyl)propanamide
CID 165438311
2-bromo-N-(2-methyl-1-phenylpropyl)acetamide
CID 10492239
3-amino-2-phenyl-N-(1-phenylpropyl)propanamide
CID 62878381
(2S)-2-(1-phenylpropylamino)propanoic acid
CID 90916236
2-amino-N-(2-methyl-1-phenylpropyl)acetamide;hydrochloride
CID 119273385
2-(methylamino)-N-(2-methyl-1-phenylpropyl)acetamide;hydrochloride
CID 119693512
N-(1-phenylpropyl)-4-propan-2-ylbenzamide
CID 17327920
(2R)-2-cyano-N-[(1R)-1-phenylpropyl]propanamide
CID 94396295

Frequently Asked Questions

What is the IUPAC name of N'-[(1R)-2-methyl-1-phenylpropyl]-N-[(1R)-1-phenylpropyl]oxamide?
The IUPAC name of N'-[(1R)-2-methyl-1-phenylpropyl]-N-[(1R)-1-phenylpropyl]oxamide (CID 124846210) is N'-[(1R)-2-methyl-1-phenylpropyl]-N-[(1R)-1-phenylpropyl]oxamide.
What is the SMILES notation for N'-[(1R)-2-methyl-1-phenylpropyl]-N-[(1R)-1-phenylpropyl]oxamide?
The canonical SMILES for N'-[(1R)-2-methyl-1-phenylpropyl]-N-[(1R)-1-phenylpropyl]oxamide is CC[C@@H](NC(=O)C(=O)N[C@@H](c1ccccc1)C(C)C)c1ccccc1.
What is the InChIKey of N'-[(1R)-2-methyl-1-phenylpropyl]-N-[(1R)-1-phenylpropyl]oxamide?
The InChIKey is IIXPALUCZKQOBF-RTBURBONSA-N. The full InChI is InChI=1S/C21H26N2O2/c1-4-18(16-11-7-5-8-12-16)22-20(24)21(25)23-19(15(2)3)17-13-9-6-10-14-17/h5-15,18-19H,4H2,1-3H3,(H,22,24)(H,23,25)/t18-,19-/m1/s1.
What are the key properties of N'-[(1R)-2-methyl-1-phenylpropyl]-N-[(1R)-1-phenylpropyl]oxamide?
N'-[(1R)-2-methyl-1-phenylpropyl]-N-[(1R)-1-phenylpropyl]oxamide has a molecular weight of 338.45 g/mol, XLogP of 3.77, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[(1R)-2-methyl-1-phenylpropyl]-N-[(1R)-1-phenylpropyl]oxamide is sourced from PubChem (CID 124846210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).