(Z)-N,N-dimethylhexadec-9-enamide

C18H35NO — CID 122698318

IUPAC(Z)-N,N-dimethylhexadec-9-enamide
SMILESCCCCCC/C=C\CCCCCCCC(=O)N(C)C
InChIInChI=1S/C18H35NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(20)19(2)3/h9-10H,4-8,11-17H2,1-3H3/b10-9-
InChIKeyOAWUHETWPJBKAB-KTKRTIGZSA-N
MW281.48 g/mol
LogP5.33
Rot. Bonds13

About (Z)-N,N-dimethylhexadec-9-enamide

(Z)-N,N-dimethylhexadec-9-enamide (PubChem CID 122698318) has the molecular formula C18H35NO and a molecular weight of 281.48 g/mol. Its IUPAC name is (Z)-N,N-dimethylhexadec-9-enamide.

Molecular Properties

Compound Name(Z)-N,N-dimethylhexadec-9-enamide
PubChem CID122698318
Molecular FormulaC18H35NO
Molecular Weight281.48 g/mol
Exact Mass281.27
IUPAC Name(Z)-N,N-dimethylhexadec-9-enamide
SMILESCCCCCC/C=C\CCCCCCCC(=O)N(C)C
InChIInChI=1S/C18H35NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(20)19(2)3/h9-10H,4-8,11-17H2,1-3H3/b10-9-
InChIKeyOAWUHETWPJBKAB-KTKRTIGZSA-N
XLogP5.33
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds13
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500281.48
LogP ≤ 55.33
H-Bond Donors ≤ 50
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

N,N-dimethyl arachidonoyl amine
CID 5283408
N,N-Dimethyloleamide
CID 5356959
9-Decenamide, N,N-dimethyl-
CID 17825184
N,N-diethyl arachidonoyl amine
CID 5283409
Oleoyl ethylamide
CID 44270319
(9Z)-1-(1-Piperidinyl)-9-octadecen-1-one
CID 5356538
(9Z)-N-Methyl-9-octadecenamide
CID 20836181
9-Octadecenamide, N,N-dibutyl-, (9Z)-
CID 6436342
(Z)-N-propyloctadec-9-enamide
CID 44270331
Pyrrolidine, 1-(1-oxo-9-octadecenyl)-, (Z)-
CID 5370392
N-Butyloleamide
CID 6436496
(Z)-N-Methoxy-N-methyloctadec-9-enamide
CID 10903483

Frequently Asked Questions

What is the IUPAC name of (Z)-N,N-dimethylhexadec-9-enamide?
The IUPAC name of (Z)-N,N-dimethylhexadec-9-enamide (CID 122698318) is (Z)-N,N-dimethylhexadec-9-enamide.
What is the SMILES notation for (Z)-N,N-dimethylhexadec-9-enamide?
The canonical SMILES for (Z)-N,N-dimethylhexadec-9-enamide is CCCCCC/C=C\CCCCCCCC(=O)N(C)C.
What is the InChIKey of (Z)-N,N-dimethylhexadec-9-enamide?
The InChIKey is OAWUHETWPJBKAB-KTKRTIGZSA-N. The full InChI is InChI=1S/C18H35NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(20)19(2)3/h9-10H,4-8,11-17H2,1-3H3/b10-9-.
What are the key properties of (Z)-N,N-dimethylhexadec-9-enamide?
(Z)-N,N-dimethylhexadec-9-enamide has a molecular weight of 281.48 g/mol, XLogP of 5.33, 13 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N,N-dimethylhexadec-9-enamide is sourced from PubChem (CID 122698318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).