N-(4-hydroxycyclohexyl)hexanamide

C12H23NO2 — CID 15133116

IUPACN-(4-hydroxycyclohexyl)hexanamide
SMILESCCCCCC(=O)NC1CCC(O)CC1
InChIInChI=1S/C12H23NO2/c1-2-3-4-5-12(15)13-10-6-8-11(14)9-7-10/h10-11,14H,2-9H2,1H3,(H,13,15)
InChIKeyGUXDXMXSMRUNOC-UHFFFAOYSA-N
MW213.32 g/mol
LogP1.99
Rot. Bonds5

About N-(4-hydroxycyclohexyl)hexanamide

N-(4-hydroxycyclohexyl)hexanamide (PubChem CID 15133116) has the molecular formula C12H23NO2 and a molecular weight of 213.32 g/mol. Its IUPAC name is N-(4-hydroxycyclohexyl)hexanamide.

Molecular Properties

Compound NameN-(4-hydroxycyclohexyl)hexanamide
PubChem CID15133116
Molecular FormulaC12H23NO2
Molecular Weight213.32 g/mol
Exact Mass213.17
IUPAC NameN-(4-hydroxycyclohexyl)hexanamide
SMILESCCCCCC(=O)NC1CCC(O)CC1
InChIInChI=1S/C12H23NO2/c1-2-3-4-5-12(15)13-10-6-8-11(14)9-7-10/h10-11,14H,2-9H2,1H3,(H,13,15)
InChIKeyGUXDXMXSMRUNOC-UHFFFAOYSA-N
XLogP1.99
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 51.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxycyclohexyl)hexanamide?
The IUPAC name of N-(4-hydroxycyclohexyl)hexanamide (CID 15133116) is N-(4-hydroxycyclohexyl)hexanamide.
What is the SMILES notation for N-(4-hydroxycyclohexyl)hexanamide?
The canonical SMILES for N-(4-hydroxycyclohexyl)hexanamide is CCCCCC(=O)NC1CCC(O)CC1.
What is the InChIKey of N-(4-hydroxycyclohexyl)hexanamide?
The InChIKey is GUXDXMXSMRUNOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO2/c1-2-3-4-5-12(15)13-10-6-8-11(14)9-7-10/h10-11,14H,2-9H2,1H3,(H,13,15).
What are the key properties of N-(4-hydroxycyclohexyl)hexanamide?
N-(4-hydroxycyclohexyl)hexanamide has a molecular weight of 213.32 g/mol, XLogP of 1.99, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxycyclohexyl)hexanamide is sourced from PubChem (CID 15133116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).