N-(4-hydroxycyclohexyl)dodecanamide

C18H35NO2 — CID 61380713

IUPACN-(4-hydroxycyclohexyl)dodecanamide
SMILESCCCCCCCCCCCC(=O)NC1CCC(O)CC1
InChIInChI=1S/C18H35NO2/c1-2-3-4-5-6-7-8-9-10-11-18(21)19-16-12-14-17(20)15-13-16/h16-17,20H,2-15H2,1H3,(H,19,21)
InChIKeyOIITXRCSPNCDHD-UHFFFAOYSA-N
MW297.48 g/mol
LogP4.33
Rot. Bonds11

About N-(4-hydroxycyclohexyl)dodecanamide

N-(4-hydroxycyclohexyl)dodecanamide (PubChem CID 61380713) has the molecular formula C18H35NO2 and a molecular weight of 297.48 g/mol. Its IUPAC name is N-(4-hydroxycyclohexyl)dodecanamide.

Molecular Properties

Compound NameN-(4-hydroxycyclohexyl)dodecanamide
PubChem CID61380713
Molecular FormulaC18H35NO2
Molecular Weight297.48 g/mol
Exact Mass297.27
IUPAC NameN-(4-hydroxycyclohexyl)dodecanamide
SMILESCCCCCCCCCCCC(=O)NC1CCC(O)CC1
InChIInChI=1S/C18H35NO2/c1-2-3-4-5-6-7-8-9-10-11-18(21)19-16-12-14-17(20)15-13-16/h16-17,20H,2-15H2,1H3,(H,19,21)
InChIKeyOIITXRCSPNCDHD-UHFFFAOYSA-N
XLogP4.33
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.48
LogP ≤ 54.33
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)dodecanamide?
The IUPAC name of N-(4-hydroxycyclohexyl)dodecanamide (CID 61380713) is N-(4-hydroxycyclohexyl)dodecanamide.
What is the SMILES notation for N-(4-hydroxycyclohexyl)dodecanamide?
The canonical SMILES for N-(4-hydroxycyclohexyl)dodecanamide is CCCCCCCCCCCC(=O)NC1CCC(O)CC1.
What is the InChIKey of N-(4-hydroxycyclohexyl)dodecanamide?
The InChIKey is OIITXRCSPNCDHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H35NO2/c1-2-3-4-5-6-7-8-9-10-11-18(21)19-16-12-14-17(20)15-13-16/h16-17,20H,2-15H2,1H3,(H,19,21).
What are the key properties of N-(4-hydroxycyclohexyl)dodecanamide?
N-(4-hydroxycyclohexyl)dodecanamide has a molecular weight of 297.48 g/mol, XLogP of 4.33, 11 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxycyclohexyl)dodecanamide is sourced from PubChem (CID 61380713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).