N-(2-methylpentadec-2-en-5-yl)acetamide

C18H35NO — CID 86166074

IUPACN-(2-methylpentadec-2-en-5-yl)acetamide
SMILESCCCCCCCCCCC(CC=C(C)C)NC(C)=O
InChIInChI=1S/C18H35NO/c1-5-6-7-8-9-10-11-12-13-18(19-17(4)20)15-14-16(2)3/h14,18H,5-13,15H2,1-4H3,(H,19,20)
InChIKeyHWMITEMKWUZEMT-UHFFFAOYSA-N
MW281.48 g/mol
LogP5.38
Rot. Bonds12

About N-(2-methylpentadec-2-en-5-yl)acetamide

N-(2-methylpentadec-2-en-5-yl)acetamide (PubChem CID 86166074) has the molecular formula C18H35NO and a molecular weight of 281.48 g/mol. Its IUPAC name is N-(2-methylpentadec-2-en-5-yl)acetamide.

Molecular Properties

Compound NameN-(2-methylpentadec-2-en-5-yl)acetamide
PubChem CID86166074
Molecular FormulaC18H35NO
Molecular Weight281.48 g/mol
Exact Mass281.27
IUPAC NameN-(2-methylpentadec-2-en-5-yl)acetamide
SMILESCCCCCCCCCCC(CC=C(C)C)NC(C)=O
InChIInChI=1S/C18H35NO/c1-5-6-7-8-9-10-11-12-13-18(19-17(4)20)15-14-16(2)3/h14,18H,5-13,15H2,1-4H3,(H,19,20)
InChIKeyHWMITEMKWUZEMT-UHFFFAOYSA-N
XLogP5.38
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds12
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500281.48
LogP ≤ 55.38
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

N-isopropyl arachidonoyl amine
CID 5283395
9-Octadecenamide, N-(1-methylethyl)-, (9Z)-
CID 6436377
N-(1S-methyl-propyl)arachidonoylamide
CID 5283401
N-(1R-methyl-propyl)arachidonoylamide
CID 5283402
(5Z,8Z,11Z,14Z)-Icosa-5,8,11,14-tetraenoic acid sec-butylamide
CID 10832336
3,7,11-Trimethyldodeca-2,6,10-trienoic acid hexadecylamide
CID 73072469
Acetamide, N-oleyl-
CID 5961270
9,12-Octadecadienamide, N-(1-methylethyl)-, (Z,Z)-
CID 6444518
N-[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenyl]butanamide
CID 44406737
N-[3-[acetyl-[3-[(10Z)-1-azacyclopentadec-10-en-1-yl]propyl]amino]propyl]acetamide
CID 15347440
N-[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenyl]propanamide
CID 44406740
(9Z,12Z,15Z)-N-propan-2-yloctadeca-9,12,15-trienamide
CID 53321666

Frequently Asked Questions

What is the IUPAC name of N-(2-methylpentadec-2-en-5-yl)acetamide?
The IUPAC name of N-(2-methylpentadec-2-en-5-yl)acetamide (CID 86166074) is N-(2-methylpentadec-2-en-5-yl)acetamide.
What is the SMILES notation for N-(2-methylpentadec-2-en-5-yl)acetamide?
The canonical SMILES for N-(2-methylpentadec-2-en-5-yl)acetamide is CCCCCCCCCCC(CC=C(C)C)NC(C)=O.
What is the InChIKey of N-(2-methylpentadec-2-en-5-yl)acetamide?
The InChIKey is HWMITEMKWUZEMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H35NO/c1-5-6-7-8-9-10-11-12-13-18(19-17(4)20)15-14-16(2)3/h14,18H,5-13,15H2,1-4H3,(H,19,20).
What are the key properties of N-(2-methylpentadec-2-en-5-yl)acetamide?
N-(2-methylpentadec-2-en-5-yl)acetamide has a molecular weight of 281.48 g/mol, XLogP of 5.38, 12 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpentadec-2-en-5-yl)acetamide is sourced from PubChem (CID 86166074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).