2-cyclohexyl-N-(4-oxocyclohexyl)acetamide

C14H23NO2 — CID 43652908

IUPAC2-cyclohexyl-N-(4-oxocyclohexyl)acetamide
SMILESO=C1CCC(NC(=O)CC2CCCCC2)CC1
InChIInChI=1S/C14H23NO2/c16-13-8-6-12(7-9-13)15-14(17)10-11-4-2-1-3-5-11/h11-12H,1-10H2,(H,15,17)
InChIKeyKSVGYCDGVBEYQD-UHFFFAOYSA-N
MW237.34 g/mol
LogP2.58
Rot. Bonds3

About 2-cyclohexyl-N-(4-oxocyclohexyl)acetamide

2-cyclohexyl-N-(4-oxocyclohexyl)acetamide (PubChem CID 43652908) has the molecular formula C14H23NO2 and a molecular weight of 237.34 g/mol. Its IUPAC name is 2-cyclohexyl-N-(4-oxocyclohexyl)acetamide.

Molecular Properties

Compound Name2-cyclohexyl-N-(4-oxocyclohexyl)acetamide
PubChem CID43652908
Molecular FormulaC14H23NO2
Molecular Weight237.34 g/mol
Exact Mass237.17
IUPAC Name2-cyclohexyl-N-(4-oxocyclohexyl)acetamide
SMILESO=C1CCC(NC(=O)CC2CCCCC2)CC1
InChIInChI=1S/C14H23NO2/c16-13-8-6-12(7-9-13)15-14(17)10-11-4-2-1-3-5-11/h11-12H,1-10H2,(H,15,17)
InChIKeyKSVGYCDGVBEYQD-UHFFFAOYSA-N
XLogP2.58
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.34
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-N-(4-oxocyclohexyl)acetamide?
The IUPAC name of 2-cyclohexyl-N-(4-oxocyclohexyl)acetamide (CID 43652908) is 2-cyclohexyl-N-(4-oxocyclohexyl)acetamide.
What is the SMILES notation for 2-cyclohexyl-N-(4-oxocyclohexyl)acetamide?
The canonical SMILES for 2-cyclohexyl-N-(4-oxocyclohexyl)acetamide is O=C1CCC(NC(=O)CC2CCCCC2)CC1.
What is the InChIKey of 2-cyclohexyl-N-(4-oxocyclohexyl)acetamide?
The InChIKey is KSVGYCDGVBEYQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO2/c16-13-8-6-12(7-9-13)15-14(17)10-11-4-2-1-3-5-11/h11-12H,1-10H2,(H,15,17).
What are the key properties of 2-cyclohexyl-N-(4-oxocyclohexyl)acetamide?
2-cyclohexyl-N-(4-oxocyclohexyl)acetamide has a molecular weight of 237.34 g/mol, XLogP of 2.58, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-N-(4-oxocyclohexyl)acetamide is sourced from PubChem (CID 43652908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).