N-[(2-chlorophenyl)methyl]-N'-(2-methoxyphenyl)oxamide

C16H15ClN2O3 — CID 2291210

IUPACN-[(2-chlorophenyl)methyl]-N'-(2-methoxyphenyl)oxamide
SMILESCOc1ccccc1NC(=O)C(=O)NCc1ccccc1Cl
InChIInChI=1S/C16H15ClN2O3/c1-22-14-9-5-4-8-13(14)19-16(21)15(20)18-10-11-6-2-3-7-12(11)17/h2-9H,10H2,1H3,(H,18,20)(H,19,21)
InChIKeyYTWHZAJWDZQLPL-UHFFFAOYSA-N
MW318.76 g/mol
LogP2.60
Rot. Bonds4

About N-[(2-chlorophenyl)methyl]-N'-(2-methoxyphenyl)oxamide

N-[(2-chlorophenyl)methyl]-N'-(2-methoxyphenyl)oxamide (PubChem CID 2291210) has the molecular formula C16H15ClN2O3 and a molecular weight of 318.76 g/mol. Its IUPAC name is N-[(2-chlorophenyl)methyl]-N'-(2-methoxyphenyl)oxamide.

Molecular Properties

Compound NameN-[(2-chlorophenyl)methyl]-N'-(2-methoxyphenyl)oxamide
PubChem CID2291210
Molecular FormulaC16H15ClN2O3
Molecular Weight318.76 g/mol
Exact Mass318.08
IUPAC NameN-[(2-chlorophenyl)methyl]-N'-(2-methoxyphenyl)oxamide
SMILESCOc1ccccc1NC(=O)C(=O)NCc1ccccc1Cl
InChIInChI=1S/C16H15ClN2O3/c1-22-14-9-5-4-8-13(14)19-16(21)15(20)18-10-11-6-2-3-7-12(11)17/h2-9H,10H2,1H3,(H,18,20)(H,19,21)
InChIKeyYTWHZAJWDZQLPL-UHFFFAOYSA-N
XLogP2.60
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.76
LogP ≤ 52.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[(2-chlorophenyl)methyl]-N'-(2-methoxyphenyl)oxamide?
The IUPAC name of N-[(2-chlorophenyl)methyl]-N'-(2-methoxyphenyl)oxamide (CID 2291210) is N-[(2-chlorophenyl)methyl]-N'-(2-methoxyphenyl)oxamide.
What is the SMILES notation for N-[(2-chlorophenyl)methyl]-N'-(2-methoxyphenyl)oxamide?
The canonical SMILES for N-[(2-chlorophenyl)methyl]-N'-(2-methoxyphenyl)oxamide is COc1ccccc1NC(=O)C(=O)NCc1ccccc1Cl.
What is the InChIKey of N-[(2-chlorophenyl)methyl]-N'-(2-methoxyphenyl)oxamide?
The InChIKey is YTWHZAJWDZQLPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15ClN2O3/c1-22-14-9-5-4-8-13(14)19-16(21)15(20)18-10-11-6-2-3-7-12(11)17/h2-9H,10H2,1H3,(H,18,20)(H,19,21).
What are the key properties of N-[(2-chlorophenyl)methyl]-N'-(2-methoxyphenyl)oxamide?
N-[(2-chlorophenyl)methyl]-N'-(2-methoxyphenyl)oxamide has a molecular weight of 318.76 g/mol, XLogP of 2.60, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-chlorophenyl)methyl]-N'-(2-methoxyphenyl)oxamide is sourced from PubChem (CID 2291210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).