N-[2-(diethylamino)ethyl]dec-2-enamide

C16H32N2O — CID 123705769

IUPACN-[2-(diethylamino)ethyl]dec-2-enamide
SMILESCCCCCCCC=CC(=O)NCCN(CC)CC
InChIInChI=1S/C16H32N2O/c1-4-7-8-9-10-11-12-13-16(19)17-14-15-18(5-2)6-3/h12-13H,4-11,14-15H2,1-3H3,(H,17,19)
InChIKeyYXQLTXOCNHETIY-UHFFFAOYSA-N
MW268.44 g/mol
LogP3.36
Rot. Bonds12

About N-[2-(diethylamino)ethyl]dec-2-enamide

N-[2-(diethylamino)ethyl]dec-2-enamide (PubChem CID 123705769) has the molecular formula C16H32N2O and a molecular weight of 268.44 g/mol. Its IUPAC name is N-[2-(diethylamino)ethyl]dec-2-enamide.

Molecular Properties

Compound NameN-[2-(diethylamino)ethyl]dec-2-enamide
PubChem CID123705769
Molecular FormulaC16H32N2O
Molecular Weight268.44 g/mol
Exact Mass268.25
IUPAC NameN-[2-(diethylamino)ethyl]dec-2-enamide
SMILESCCCCCCCC=CC(=O)NCCN(CC)CC
InChIInChI=1S/C16H32N2O/c1-4-7-8-9-10-11-12-13-16(19)17-14-15-18(5-2)6-3/h12-13H,4-11,14-15H2,1-3H3,(H,17,19)
InChIKeyYXQLTXOCNHETIY-UHFFFAOYSA-N
XLogP3.36
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds12
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': 'Michael_acceptor_1', 'substructure': 'N/A'}

Analyze N-[2-(diethylamino)ethyl]dec-2-enamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(E)-N-[3-(diethylamino)propyl]dec-2-enamide
CID 86694810
N-[2-(icos-2-enoylamino)ethyl]icos-2-enamide
CID 87333364
(E)-N-butyldec-2-enamide
CID 160628271
(E)-N-[3-[3-hydroxypropyl-[3-[[(E)-oct-2-enoyl]amino]propyl]amino]propyl]oct-2-enamide
CID 101285798
(E)-N-[3-[methyl-[3-[[(E)-oct-2-enoyl]amino]propyl]amino]propyl]oct-2-enamide
CID 102116540
(E)-N-[2-(dimethylamino)ethyl]hept-2-enamide
CID 102117807
N-(2-sulfanylethyl)dec-2-enamide
CID 88633886
3-[[(E)-oct-2-enoyl]amino]propanoic acid
CID 101276344
2-[[(E)-hexadec-2-enoyl]amino]acetic acid
CID 139292150
2-(dodec-2-enoylamino)acetic acid
CID 75296754
N-[2-[bis[2-(octadec-9-enoylamino)ethyl]amino]ethyl]octadec-9-enamide
CID 85077312
4-[[(E)-dodec-2-enoyl]amino]butane-1-sulfonic acid
CID 101284524

Frequently Asked Questions

What is the IUPAC name of N-[2-(diethylamino)ethyl]dec-2-enamide?
The IUPAC name of N-[2-(diethylamino)ethyl]dec-2-enamide (CID 123705769) is N-[2-(diethylamino)ethyl]dec-2-enamide.
What is the SMILES notation for N-[2-(diethylamino)ethyl]dec-2-enamide?
The canonical SMILES for N-[2-(diethylamino)ethyl]dec-2-enamide is CCCCCCCC=CC(=O)NCCN(CC)CC.
What is the InChIKey of N-[2-(diethylamino)ethyl]dec-2-enamide?
The InChIKey is YXQLTXOCNHETIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O/c1-4-7-8-9-10-11-12-13-16(19)17-14-15-18(5-2)6-3/h12-13H,4-11,14-15H2,1-3H3,(H,17,19).
What are the key properties of N-[2-(diethylamino)ethyl]dec-2-enamide?
N-[2-(diethylamino)ethyl]dec-2-enamide has a molecular weight of 268.44 g/mol, XLogP of 3.36, 12 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(diethylamino)ethyl]dec-2-enamide is sourced from PubChem (CID 123705769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).