N-(2-chlorophenyl)-N'-[(1R)-1-phenylethyl]oxamide

C16H15ClN2O2 — CID 2291188

IUPACN-(2-chlorophenyl)-N'-[(1R)-1-phenylethyl]oxamide
SMILESC[C@@H](NC(=O)C(=O)Nc1ccccc1Cl)c1ccccc1
InChIInChI=1S/C16H15ClN2O2/c1-11(12-7-3-2-4-8-12)18-15(20)16(21)19-14-10-6-5-9-13(14)17/h2-11H,1H3,(H,18,20)(H,19,21)/t11-/m1/s1
InChIKeyCEHVYRJDHUJIND-LLVKDONJSA-N
MW302.76 g/mol
LogP3.16
Rot. Bonds3

About N-(2-chlorophenyl)-N'-[(1R)-1-phenylethyl]oxamide

N-(2-chlorophenyl)-N'-[(1R)-1-phenylethyl]oxamide (PubChem CID 2291188) has the molecular formula C16H15ClN2O2 and a molecular weight of 302.76 g/mol. Its IUPAC name is N-(2-chlorophenyl)-N'-[(1R)-1-phenylethyl]oxamide.

Molecular Properties

Compound NameN-(2-chlorophenyl)-N'-[(1R)-1-phenylethyl]oxamide
PubChem CID2291188
Molecular FormulaC16H15ClN2O2
Molecular Weight302.76 g/mol
Exact Mass302.08
IUPAC NameN-(2-chlorophenyl)-N'-[(1R)-1-phenylethyl]oxamide
SMILESC[C@@H](NC(=O)C(=O)Nc1ccccc1Cl)c1ccccc1
InChIInChI=1S/C16H15ClN2O2/c1-11(12-7-3-2-4-8-12)18-15(20)16(21)19-14-10-6-5-9-13(14)17/h2-11H,1H3,(H,18,20)(H,19,21)/t11-/m1/s1
InChIKeyCEHVYRJDHUJIND-LLVKDONJSA-N
XLogP3.16
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.76
LogP ≤ 53.16
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

1-(2-chlorophenyl)-3-[1-(4-chlorophenyl)ethyl]urea
CID 17182401
N-(2-chlorophenyl)-2-phenylpropanamide
CID 70678301
N-(5-chloro-2-methoxyphenyl)-N'-(1-phenylethyl)oxamide
CID 2986502
N-(5-chloro-2-methoxyphenyl)-N'-[(1R)-1-phenylethyl]oxamide
CID 7378760
N-(2,3-dichlorophenyl)-N'-[1-(4-ethylphenyl)ethyl]oxamide
CID 108500692
(Z)-N-(2-chlorophenyl)-2-cyano-3-(1-phenylethylamino)prop-2-enamide
CID 108824317
N-(2,4-difluorophenyl)-N'-[(1R)-1-phenylethyl]oxamide
CID 7393082
N-(2,5-difluorophenyl)-N'-(1-phenylethyl)oxamide
CID 44998519
1-benzhydryl-3-(2-chlorophenyl)urea
CID 108867386
2-amino-3-chloro-N-(1-phenylethyl)benzamide
CID 82546896
1-phenylethyl N-(2-chlorophenyl)carbamate
CID 174361176
N-(4-iodophenyl)-N'-(1-phenylethyl)oxamide
CID 108507943

Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-N'-[(1R)-1-phenylethyl]oxamide?
The IUPAC name of N-(2-chlorophenyl)-N'-[(1R)-1-phenylethyl]oxamide (CID 2291188) is N-(2-chlorophenyl)-N'-[(1R)-1-phenylethyl]oxamide.
What is the SMILES notation for N-(2-chlorophenyl)-N'-[(1R)-1-phenylethyl]oxamide?
The canonical SMILES for N-(2-chlorophenyl)-N'-[(1R)-1-phenylethyl]oxamide is C[C@@H](NC(=O)C(=O)Nc1ccccc1Cl)c1ccccc1.
What is the InChIKey of N-(2-chlorophenyl)-N'-[(1R)-1-phenylethyl]oxamide?
The InChIKey is CEHVYRJDHUJIND-LLVKDONJSA-N. The full InChI is InChI=1S/C16H15ClN2O2/c1-11(12-7-3-2-4-8-12)18-15(20)16(21)19-14-10-6-5-9-13(14)17/h2-11H,1H3,(H,18,20)(H,19,21)/t11-/m1/s1.
What are the key properties of N-(2-chlorophenyl)-N'-[(1R)-1-phenylethyl]oxamide?
N-(2-chlorophenyl)-N'-[(1R)-1-phenylethyl]oxamide has a molecular weight of 302.76 g/mol, XLogP of 3.16, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)-N'-[(1R)-1-phenylethyl]oxamide is sourced from PubChem (CID 2291188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).