N-tetradecyloctadec-9-enamide

C32H63NO — CID 90860718

IUPACN-tetradecyloctadec-9-enamide
SMILESCCCCCCCCC=CCCCCCCCC(=O)NCCCCCCCCCCCCCC
InChIInChI=1S/C32H63NO/c1-3-5-7-9-11-13-15-17-18-19-20-22-24-26-28-30-32(34)33-31-29-27-25-23-21-16-14-12-10-8-6-4-2/h17-18H,3-16,19-31H2,1-2H3,(H,33,34)
InChIKeyPLSJCWNUTYXBAP-UHFFFAOYSA-N
MW477.86 g/mol
LogP10.84
Rot. Bonds28

About N-tetradecyloctadec-9-enamide

N-tetradecyloctadec-9-enamide (PubChem CID 90860718) has the molecular formula C32H63NO and a molecular weight of 477.86 g/mol. Its IUPAC name is N-tetradecyloctadec-9-enamide.

Molecular Properties

Compound NameN-tetradecyloctadec-9-enamide
PubChem CID90860718
Molecular FormulaC32H63NO
Molecular Weight477.86 g/mol
Exact Mass477.49
IUPAC NameN-tetradecyloctadec-9-enamide
SMILESCCCCCCCCC=CCCCCCCCC(=O)NCCCCCCCCCCCCCC
InChIInChI=1S/C32H63NO/c1-3-5-7-9-11-13-15-17-18-19-20-22-24-26-28-30-32(34)33-31-29-27-25-23-21-16-14-12-10-8-6-4-2/h17-18H,3-16,19-31H2,1-2H3,(H,33,34)
InChIKeyPLSJCWNUTYXBAP-UHFFFAOYSA-N
XLogP10.84
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds28
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500477.86
LogP ≤ 510.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(E)-N-[6-[[(E)-octadec-9-enoyl]amino]hexyl]octadec-9-enamide
CID 6296113
N-docos-13-enylhexadecanamide
CID 54193549
(Z)-N-tetradecyldocos-13-enamide
CID 142707286
N-hexyloctadec-9-enamide
CID 57210632
(Z)-N-hexadecyloctadec-9-enamide
CID 87108335
(E)-N-pentadecyloctadec-9-enamide
CID 166963229
(Z)-N-dodecyldocos-13-enamide
CID 87733981
N-[18-[2-(octadec-9-enoylamino)ethylamino]-18-oxooctadec-9-enyl]docos-13-enamide
CID 123913182
(Z)-N-[3-[[(Z)-octadec-9-enoyl]amino]propyl]octadec-9-enamide
CID 87571008
(Z)-N-butyloctadec-9-enamide
CID 6436496
N-hexadecyloctadec-9-enamide;sulfuric acid
CID 173436685
N-[2-[[(Z)-octadec-9-enoyl]amino]ethyl]octadecanamide
CID 58048841

Frequently Asked Questions

What is the IUPAC name of N-tetradecyloctadec-9-enamide?
The IUPAC name of N-tetradecyloctadec-9-enamide (CID 90860718) is N-tetradecyloctadec-9-enamide.
What is the SMILES notation for N-tetradecyloctadec-9-enamide?
The canonical SMILES for N-tetradecyloctadec-9-enamide is CCCCCCCCC=CCCCCCCCC(=O)NCCCCCCCCCCCCCC.
What is the InChIKey of N-tetradecyloctadec-9-enamide?
The InChIKey is PLSJCWNUTYXBAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H63NO/c1-3-5-7-9-11-13-15-17-18-19-20-22-24-26-28-30-32(34)33-31-29-27-25-23-21-16-14-12-10-8-6-4-2/h17-18H,3-16,19-31H2,1-2H3,(H,33,34).
What are the key properties of N-tetradecyloctadec-9-enamide?
N-tetradecyloctadec-9-enamide has a molecular weight of 477.86 g/mol, XLogP of 10.84, 28 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-tetradecyloctadec-9-enamide is sourced from PubChem (CID 90860718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).