N,N-diethyl-11-hydroxyundecanamide

C15H31NO2 — CID 11747269

IUPACN,N-diethyl-11-hydroxyundecanamide
SMILESCCN(CC)C(=O)CCCCCCCCCCO
InChIInChI=1S/C15H31NO2/c1-3-16(4-2)15(18)13-11-9-7-5-6-8-10-12-14-17/h17H,3-14H2,1-2H3
InChIKeyLJVKFXAANPYSIQ-UHFFFAOYSA-N
MW257.42 g/mol
LogP3.36
Rot. Bonds12

About N,N-diethyl-11-hydroxyundecanamide

N,N-diethyl-11-hydroxyundecanamide (PubChem CID 11747269) has the molecular formula C15H31NO2 and a molecular weight of 257.42 g/mol. Its IUPAC name is N,N-diethyl-11-hydroxyundecanamide.

Molecular Properties

Compound NameN,N-diethyl-11-hydroxyundecanamide
PubChem CID11747269
Molecular FormulaC15H31NO2
Molecular Weight257.42 g/mol
Exact Mass257.24
IUPAC NameN,N-diethyl-11-hydroxyundecanamide
SMILESCCN(CC)C(=O)CCCCCCCCCCO
InChIInChI=1S/C15H31NO2/c1-3-16(4-2)15(18)13-11-9-7-5-6-8-10-12-14-17/h17H,3-14H2,1-2H3
InChIKeyLJVKFXAANPYSIQ-UHFFFAOYSA-N
XLogP3.36
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds12
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.42
LogP ≤ 53.36
H-Bond Donors ≤ 51
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,N-diethyl-11-hydroxyundecanamide?
The IUPAC name of N,N-diethyl-11-hydroxyundecanamide (CID 11747269) is N,N-diethyl-11-hydroxyundecanamide.
What is the SMILES notation for N,N-diethyl-11-hydroxyundecanamide?
The canonical SMILES for N,N-diethyl-11-hydroxyundecanamide is CCN(CC)C(=O)CCCCCCCCCCO.
What is the InChIKey of N,N-diethyl-11-hydroxyundecanamide?
The InChIKey is LJVKFXAANPYSIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31NO2/c1-3-16(4-2)15(18)13-11-9-7-5-6-8-10-12-14-17/h17H,3-14H2,1-2H3.
What are the key properties of N,N-diethyl-11-hydroxyundecanamide?
N,N-diethyl-11-hydroxyundecanamide has a molecular weight of 257.42 g/mol, XLogP of 3.36, 12 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-11-hydroxyundecanamide is sourced from PubChem (CID 11747269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).