N-[3-(dimethylamino)propyl]undec-10-enamide

C16H32N2O — CID 57483251

IUPACN-[3-(dimethylamino)propyl]undec-10-enamide
SMILESC=CCCCCCCCCC(=O)NCCCN(C)C
InChIInChI=1S/C16H32N2O/c1-4-5-6-7-8-9-10-11-13-16(19)17-14-12-15-18(2)3/h4H,1,5-15H2,2-3H3,(H,17,19)
InChIKeyAYGYDSKVANLUER-UHFFFAOYSA-N
MW268.44 g/mol
LogP3.36
Rot. Bonds13

About N-[3-(dimethylamino)propyl]undec-10-enamide

N-[3-(dimethylamino)propyl]undec-10-enamide (PubChem CID 57483251) has the molecular formula C16H32N2O and a molecular weight of 268.44 g/mol. Its IUPAC name is N-[3-(dimethylamino)propyl]undec-10-enamide.

Molecular Properties

Compound NameN-[3-(dimethylamino)propyl]undec-10-enamide
PubChem CID57483251
Molecular FormulaC16H32N2O
Molecular Weight268.44 g/mol
Exact Mass268.25
IUPAC NameN-[3-(dimethylamino)propyl]undec-10-enamide
SMILESC=CCCCCCCCCC(=O)NCCCN(C)C
InChIInChI=1S/C16H32N2O/c1-4-5-6-7-8-9-10-11-13-16(19)17-14-12-15-18(2)3/h4H,1,5-15H2,2-3H3,(H,17,19)
InChIKeyAYGYDSKVANLUER-UHFFFAOYSA-N
XLogP3.36
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds13
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.44
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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

Stearyl erucamide
CID 6436363
9-Octadecenamide, N,N'-1,2-ethanediylbis-, (9Z,9'Z)-
CID 66966
Oleyl palmitamide
CID 6436436
N-(3-(Dimethylamino)propyl)oleamide
CID 6436063
Trimethyl-3-((1-oxo-10-undecenyl)amino)propylammonium methyl sulphate
CID 3038532
(9Z)-N-(9Z)-9-Octadecen-1-yl-9-octadecenamide
CID 51341857
Linoleamidopropyl Dimethylamine
CID 16745071
N,N-Diethyl-N'-oleoylethylenediamine
CID 5368041
Ethylene dioleamide
CID 6436065
9-Octadecenamide, N,N'-[(methylimino)di-3,1-propanediyl]bis-, (9Z,9'Z)-
CID 6441654
Undecylenamidopropyl Betaine
CID 9949269
9-Octadecenamide, N-(1-methylethyl)-, (9Z)-
CID 6436377

Frequently Asked Questions

What is the IUPAC name of N-[3-(dimethylamino)propyl]undec-10-enamide?
The IUPAC name of N-[3-(dimethylamino)propyl]undec-10-enamide (CID 57483251) is N-[3-(dimethylamino)propyl]undec-10-enamide.
What is the SMILES notation for N-[3-(dimethylamino)propyl]undec-10-enamide?
The canonical SMILES for N-[3-(dimethylamino)propyl]undec-10-enamide is C=CCCCCCCCCC(=O)NCCCN(C)C.
What is the InChIKey of N-[3-(dimethylamino)propyl]undec-10-enamide?
The InChIKey is AYGYDSKVANLUER-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O/c1-4-5-6-7-8-9-10-11-13-16(19)17-14-12-15-18(2)3/h4H,1,5-15H2,2-3H3,(H,17,19).
What are the key properties of N-[3-(dimethylamino)propyl]undec-10-enamide?
N-[3-(dimethylamino)propyl]undec-10-enamide has a molecular weight of 268.44 g/mol, XLogP of 3.36, 13 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(dimethylamino)propyl]undec-10-enamide is sourced from PubChem (CID 57483251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).