N-[2-(dipropylamino)ethyl]hexadecanamide

C24H50N2O — CID 19068804

IUPACN-[2-(dipropylamino)ethyl]hexadecanamide
SMILESCCCCCCCCCCCCCCCC(=O)NCCN(CCC)CCC
InChIInChI=1S/C24H50N2O/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-19-24(27)25-20-23-26(21-5-2)22-6-3/h4-23H2,1-3H3,(H,25,27)
InChIKeyJEPKTOMZDBCLDB-UHFFFAOYSA-N
MW382.68 g/mol
LogP6.71
Rot. Bonds21

About N-[2-(dipropylamino)ethyl]hexadecanamide

N-[2-(dipropylamino)ethyl]hexadecanamide (PubChem CID 19068804) has the molecular formula C24H50N2O and a molecular weight of 382.68 g/mol. Its IUPAC name is N-[2-(dipropylamino)ethyl]hexadecanamide.

Molecular Properties

Compound NameN-[2-(dipropylamino)ethyl]hexadecanamide
PubChem CID19068804
Molecular FormulaC24H50N2O
Molecular Weight382.68 g/mol
Exact Mass382.39
IUPAC NameN-[2-(dipropylamino)ethyl]hexadecanamide
SMILESCCCCCCCCCCCCCCCC(=O)NCCN(CCC)CCC
InChIInChI=1S/C24H50N2O/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-19-24(27)25-20-23-26(21-5-2)22-6-3/h4-23H2,1-3H3,(H,25,27)
InChIKeyJEPKTOMZDBCLDB-UHFFFAOYSA-N
XLogP6.71
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds21
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500382.68
LogP ≤ 56.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[2-(dibutylamino)ethyl]dodecanamide
CID 23372327
N-[2-[2-(heptanoylamino)ethyl-[2-(propanoylamino)ethyl]amino]ethyl]heptanamide
CID 90956908
N-[2-[bis(2-hydroxyethyl)amino]ethyl]henicosanamide
CID 102116577
N-[2-[2-(butanoylamino)ethyl-propylamino]ethyl]pentanamide
CID 156706251
N-[2-[bis[2-(octadec-9-enoylamino)ethyl]amino]ethyl]octadec-9-enamide
CID 85077312
N-[2-[2-(hexadecanoylamino)ethyl-[2-(4-oxobutanoylamino)ethyl]amino]ethyl]hexadecanamide
CID 58422822
N-[2-[2-aminoethyl-[2-(hexanoylamino)ethyl]amino]ethyl]hexanamide
CID 53387315
N-[3-[3-[bis[3-(tetradecanoylamino)propyl]amino]propyl-[3-(tetradecanoylamino)propyl]amino]propyl]tetradecanamide
CID 88929141
ethane;N-heptylhexadecanamide
CID 142440540
ethane;N-octylhexanamide
CID 177149935
ethane;N-propylheptanamide
CID 145289188
N-[2-(heptadecanoylamino)ethyl]heptadecanamide
CID 22065407

Frequently Asked Questions

What is the IUPAC name of N-[2-(dipropylamino)ethyl]hexadecanamide?
The IUPAC name of N-[2-(dipropylamino)ethyl]hexadecanamide (CID 19068804) is N-[2-(dipropylamino)ethyl]hexadecanamide.
What is the SMILES notation for N-[2-(dipropylamino)ethyl]hexadecanamide?
The canonical SMILES for N-[2-(dipropylamino)ethyl]hexadecanamide is CCCCCCCCCCCCCCCC(=O)NCCN(CCC)CCC.
What is the InChIKey of N-[2-(dipropylamino)ethyl]hexadecanamide?
The InChIKey is JEPKTOMZDBCLDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H50N2O/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-19-24(27)25-20-23-26(21-5-2)22-6-3/h4-23H2,1-3H3,(H,25,27).
What are the key properties of N-[2-(dipropylamino)ethyl]hexadecanamide?
N-[2-(dipropylamino)ethyl]hexadecanamide has a molecular weight of 382.68 g/mol, XLogP of 6.71, 21 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dipropylamino)ethyl]hexadecanamide is sourced from PubChem (CID 19068804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).