N'-(2-chlorophenyl)-N-cyclohexyloxamide

C14H17ClN2O2 — CID 7541659

IUPACN'-(2-chlorophenyl)-N-cyclohexyloxamide
SMILESO=C(Nc1ccccc1Cl)C(=O)NC1CCCCC1
InChIInChI=1S/C14H17ClN2O2/c15-11-8-4-5-9-12(11)17-14(19)13(18)16-10-6-2-1-3-7-10/h4-5,8-10H,1-3,6-7H2,(H,16,18)(H,17,19)
InChIKeyYXTKFWRVBYQEIK-UHFFFAOYSA-N
MW280.75 g/mol
LogP2.73
Rot. Bonds2

About N'-(2-chlorophenyl)-N-cyclohexyloxamide

N'-(2-chlorophenyl)-N-cyclohexyloxamide (PubChem CID 7541659) has the molecular formula C14H17ClN2O2 and a molecular weight of 280.75 g/mol. Its IUPAC name is N'-(2-chlorophenyl)-N-cyclohexyloxamide.

Molecular Properties

Compound NameN'-(2-chlorophenyl)-N-cyclohexyloxamide
PubChem CID7541659
Molecular FormulaC14H17ClN2O2
Molecular Weight280.75 g/mol
Exact Mass280.10
IUPAC NameN'-(2-chlorophenyl)-N-cyclohexyloxamide
SMILESO=C(Nc1ccccc1Cl)C(=O)NC1CCCCC1
InChIInChI=1S/C14H17ClN2O2/c15-11-8-4-5-9-12(11)17-14(19)13(18)16-10-6-2-1-3-7-10/h4-5,8-10H,1-3,6-7H2,(H,16,18)(H,17,19)
InChIKeyYXTKFWRVBYQEIK-UHFFFAOYSA-N
XLogP2.73
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.75
LogP ≤ 52.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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)-N-cyclohexyloxamide?
The IUPAC name of N'-(2-chlorophenyl)-N-cyclohexyloxamide (CID 7541659) is N'-(2-chlorophenyl)-N-cyclohexyloxamide.
What is the SMILES notation for N'-(2-chlorophenyl)-N-cyclohexyloxamide?
The canonical SMILES for N'-(2-chlorophenyl)-N-cyclohexyloxamide is O=C(Nc1ccccc1Cl)C(=O)NC1CCCCC1.
What is the InChIKey of N'-(2-chlorophenyl)-N-cyclohexyloxamide?
The InChIKey is YXTKFWRVBYQEIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17ClN2O2/c15-11-8-4-5-9-12(11)17-14(19)13(18)16-10-6-2-1-3-7-10/h4-5,8-10H,1-3,6-7H2,(H,16,18)(H,17,19).
What are the key properties of N'-(2-chlorophenyl)-N-cyclohexyloxamide?
N'-(2-chlorophenyl)-N-cyclohexyloxamide has a molecular weight of 280.75 g/mol, XLogP of 2.73, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-chlorophenyl)-N-cyclohexyloxamide is sourced from PubChem (CID 7541659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).