N,N-bis(prop-2-enyl)octadecanamide

C24H45NO — CID 21304286

IUPACN,N-bis(prop-2-enyl)octadecanamide
SMILESC=CCN(CC=C)C(=O)CCCCCCCCCCCCCCCCC
InChIInChI=1S/C24H45NO/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-24(26)25(22-5-2)23-6-3/h5-6H,2-4,7-23H2,1H3
InChIKeyIFCXIOHFRNKIMY-UHFFFAOYSA-N
MW363.63 g/mol
LogP7.45
Rot. Bonds20

About N,N-bis(prop-2-enyl)octadecanamide

N,N-bis(prop-2-enyl)octadecanamide (PubChem CID 21304286) has the molecular formula C24H45NO and a molecular weight of 363.63 g/mol. Its IUPAC name is N,N-bis(prop-2-enyl)octadecanamide.

Molecular Properties

Compound NameN,N-bis(prop-2-enyl)octadecanamide
PubChem CID21304286
Molecular FormulaC24H45NO
Molecular Weight363.63 g/mol
Exact Mass363.35
IUPAC NameN,N-bis(prop-2-enyl)octadecanamide
SMILESC=CCN(CC=C)C(=O)CCCCCCCCCCCCCCCCC
InChIInChI=1S/C24H45NO/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-24(26)25(22-5-2)23-6-3/h5-6H,2-4,7-23H2,1H3
InChIKeyIFCXIOHFRNKIMY-UHFFFAOYSA-N
XLogP7.45
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds20
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500363.63
LogP ≤ 57.45
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-Diethyldodecanamide
CID 18783
N,N-Dibutyldodecanamide
CID 219313
1-(4-Ethyl-4-prop-2-enylpiperazin-4-ium-1-yl)hexadecan-1-one bromide
CID 24944583
1-(4-Methyl-4-prop-2-enylpiperazin-4-ium-1-yl)docosan-1-one bromide
CID 24944739
1-(4-Methyl-4-prop-2-enyl-1,4-diazepan-4-ium-1-yl)tetradecan-1-one bromide
CID 68602468
N,N-dibutyldecanamide
CID 304086
N,N-Dipropyldecanamide
CID 90658
9-Octadecenamide, N,N-dibutyl-, (9Z)-
CID 6436342
Diethyl-[2-[methyl(tetradecanoyl)amino]ethyl]-prop-2-enylazanium bromide
CID 72196399
Dimethyl-[3-[methyl(tetradecanoyl)amino]propyl]-prop-2-enylazanium bromide
CID 72196406
Diethyl-[2-[hexadecanoyl(methyl)amino]ethyl]-prop-2-enylazanium bromide
CID 72196572
3-[Hexadecanoyl(methyl)amino]propyl-dimethyl-prop-2-enylazanium bromide
CID 72196580

Frequently Asked Questions

What is the IUPAC name of N,N-bis(prop-2-enyl)octadecanamide?
The IUPAC name of N,N-bis(prop-2-enyl)octadecanamide (CID 21304286) is N,N-bis(prop-2-enyl)octadecanamide.
What is the SMILES notation for N,N-bis(prop-2-enyl)octadecanamide?
The canonical SMILES for N,N-bis(prop-2-enyl)octadecanamide is C=CCN(CC=C)C(=O)CCCCCCCCCCCCCCCCC.
What is the InChIKey of N,N-bis(prop-2-enyl)octadecanamide?
The InChIKey is IFCXIOHFRNKIMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H45NO/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-24(26)25(22-5-2)23-6-3/h5-6H,2-4,7-23H2,1H3.
What are the key properties of N,N-bis(prop-2-enyl)octadecanamide?
N,N-bis(prop-2-enyl)octadecanamide has a molecular weight of 363.63 g/mol, XLogP of 7.45, 20 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(prop-2-enyl)octadecanamide is sourced from PubChem (CID 21304286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).