N-cyclohexyl-N'-phenyloxamide

C14H18N2O2 — CID 2271218

IUPACN-cyclohexyl-N'-phenyloxamide
SMILESO=C(Nc1ccccc1)C(=O)NC1CCCCC1
InChIInChI=1S/C14H18N2O2/c17-13(15-11-7-3-1-4-8-11)14(18)16-12-9-5-2-6-10-12/h1,3-4,7-8,12H,2,5-6,9-10H2,(H,15,17)(H,16,18)
InChIKeyHXPFZEWELFHRDN-UHFFFAOYSA-N
MW246.31 g/mol
LogP2.07
Rot. Bonds2

About N-cyclohexyl-N'-phenyloxamide

N-cyclohexyl-N'-phenyloxamide (PubChem CID 2271218) has the molecular formula C14H18N2O2 and a molecular weight of 246.31 g/mol. Its IUPAC name is N-cyclohexyl-N'-phenyloxamide.

Molecular Properties

Compound NameN-cyclohexyl-N'-phenyloxamide
PubChem CID2271218
Molecular FormulaC14H18N2O2
Molecular Weight246.31 g/mol
Exact Mass246.14
IUPAC NameN-cyclohexyl-N'-phenyloxamide
SMILESO=C(Nc1ccccc1)C(=O)NC1CCCCC1
InChIInChI=1S/C14H18N2O2/c17-13(15-11-7-3-1-4-8-11)14(18)16-12-9-5-2-6-10-12/h1,3-4,7-8,12H,2,5-6,9-10H2,(H,15,17)(H,16,18)
InChIKeyHXPFZEWELFHRDN-UHFFFAOYSA-N
XLogP2.07
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 52.07
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-cyclohexyl-N'-phenyloxamide?
The IUPAC name of N-cyclohexyl-N'-phenyloxamide (CID 2271218) is N-cyclohexyl-N'-phenyloxamide.
What is the SMILES notation for N-cyclohexyl-N'-phenyloxamide?
The canonical SMILES for N-cyclohexyl-N'-phenyloxamide is O=C(Nc1ccccc1)C(=O)NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-N'-phenyloxamide?
The InChIKey is HXPFZEWELFHRDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O2/c17-13(15-11-7-3-1-4-8-11)14(18)16-12-9-5-2-6-10-12/h1,3-4,7-8,12H,2,5-6,9-10H2,(H,15,17)(H,16,18).
What are the key properties of N-cyclohexyl-N'-phenyloxamide?
N-cyclohexyl-N'-phenyloxamide has a molecular weight of 246.31 g/mol, XLogP of 2.07, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N'-phenyloxamide is sourced from PubChem (CID 2271218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).