4-cyclohexylbutanamide

C10H19NO — CID 548040

IUPAC4-cyclohexylbutanamide
SMILESNC(=O)CCCC1CCCCC1
InChIInChI=1S/C10H19NO/c11-10(12)8-4-7-9-5-2-1-3-6-9/h9H,1-8H2,(H2,11,12)
InChIKeyHZGJWEZZXLGUAU-UHFFFAOYSA-N
MW169.27 g/mol
LogP2.22
Rot. Bonds4

About 4-cyclohexylbutanamide

4-cyclohexylbutanamide (PubChem CID 548040) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is 4-cyclohexylbutanamide.

Molecular Properties

Compound Name4-cyclohexylbutanamide
PubChem CID548040
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name4-cyclohexylbutanamide
SMILESNC(=O)CCCC1CCCCC1
InChIInChI=1S/C10H19NO/c11-10(12)8-4-7-9-5-2-1-3-6-9/h9H,1-8H2,(H2,11,12)
InChIKeyHZGJWEZZXLGUAU-UHFFFAOYSA-N
XLogP2.22
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-cyclohexylbutanamide?
The IUPAC name of 4-cyclohexylbutanamide (CID 548040) is 4-cyclohexylbutanamide.
What is the SMILES notation for 4-cyclohexylbutanamide?
The canonical SMILES for 4-cyclohexylbutanamide is NC(=O)CCCC1CCCCC1.
What is the InChIKey of 4-cyclohexylbutanamide?
The InChIKey is HZGJWEZZXLGUAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c11-10(12)8-4-7-9-5-2-1-3-6-9/h9H,1-8H2,(H2,11,12).
What are the key properties of 4-cyclohexylbutanamide?
4-cyclohexylbutanamide has a molecular weight of 169.27 g/mol, XLogP of 2.22, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclohexylbutanamide is sourced from PubChem (CID 548040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).