N-cyclohexyl-N',N'-diethyloxamide

C12H22N2O2 — CID 14925039

IUPACN-cyclohexyl-N',N'-diethyloxamide
SMILESCCN(CC)C(=O)C(=O)NC1CCCCC1
InChIInChI=1S/C12H22N2O2/c1-3-14(4-2)12(16)11(15)13-10-8-6-5-7-9-10/h10H,3-9H2,1-2H3,(H,13,15)
InChIKeyFNPVKTSHXJVJFH-UHFFFAOYSA-N
MW226.32 g/mol
LogP1.30
Rot. Bonds3

About N-cyclohexyl-N',N'-diethyloxamide

N-cyclohexyl-N',N'-diethyloxamide (PubChem CID 14925039) has the molecular formula C12H22N2O2 and a molecular weight of 226.32 g/mol. Its IUPAC name is N-cyclohexyl-N',N'-diethyloxamide.

Molecular Properties

Compound NameN-cyclohexyl-N',N'-diethyloxamide
PubChem CID14925039
Molecular FormulaC12H22N2O2
Molecular Weight226.32 g/mol
Exact Mass226.17
IUPAC NameN-cyclohexyl-N',N'-diethyloxamide
SMILESCCN(CC)C(=O)C(=O)NC1CCCCC1
InChIInChI=1S/C12H22N2O2/c1-3-14(4-2)12(16)11(15)13-10-8-6-5-7-9-10/h10H,3-9H2,1-2H3,(H,13,15)
InChIKeyFNPVKTSHXJVJFH-UHFFFAOYSA-N
XLogP1.30
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 51.30
H-Bond Donors ≤ 51
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',N'-diethyloxamide?
The IUPAC name of N-cyclohexyl-N',N'-diethyloxamide (CID 14925039) is N-cyclohexyl-N',N'-diethyloxamide.
What is the SMILES notation for N-cyclohexyl-N',N'-diethyloxamide?
The canonical SMILES for N-cyclohexyl-N',N'-diethyloxamide is CCN(CC)C(=O)C(=O)NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-N',N'-diethyloxamide?
The InChIKey is FNPVKTSHXJVJFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O2/c1-3-14(4-2)12(16)11(15)13-10-8-6-5-7-9-10/h10H,3-9H2,1-2H3,(H,13,15).
What are the key properties of N-cyclohexyl-N',N'-diethyloxamide?
N-cyclohexyl-N',N'-diethyloxamide has a molecular weight of 226.32 g/mol, XLogP of 1.30, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N',N'-diethyloxamide is sourced from PubChem (CID 14925039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).