2-ethyl-8-(2-hydroxyhexylamino)octanamide

C16H34N2O2 — CID 88760259

IUPAC2-ethyl-8-(2-hydroxyhexylamino)octanamide
SMILESCCCCC(O)CNCCCCCCC(CC)C(N)=O
InChIInChI=1S/C16H34N2O2/c1-3-5-11-15(19)13-18-12-9-7-6-8-10-14(4-2)16(17)20/h14-15,18-19H,3-13H2,1-2H3,(H2,17,20)
InChIKeyPAFKFMDVIXXXME-UHFFFAOYSA-N
MW286.46 g/mol
LogP2.59
Rot. Bonds14

About 2-ethyl-8-(2-hydroxyhexylamino)octanamide

2-ethyl-8-(2-hydroxyhexylamino)octanamide (PubChem CID 88760259) has the molecular formula C16H34N2O2 and a molecular weight of 286.46 g/mol. Its IUPAC name is 2-ethyl-8-(2-hydroxyhexylamino)octanamide.

Molecular Properties

Compound Name2-ethyl-8-(2-hydroxyhexylamino)octanamide
PubChem CID88760259
Molecular FormulaC16H34N2O2
Molecular Weight286.46 g/mol
Exact Mass286.26
IUPAC Name2-ethyl-8-(2-hydroxyhexylamino)octanamide
SMILESCCCCC(O)CNCCCCCCC(CC)C(N)=O
InChIInChI=1S/C16H34N2O2/c1-3-5-11-15(19)13-18-12-9-7-6-8-10-14(4-2)16(17)20/h14-15,18-19H,3-13H2,1-2H3,(H2,17,20)
InChIKeyPAFKFMDVIXXXME-UHFFFAOYSA-N
XLogP2.59
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds14
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.46
LogP ≤ 52.59
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-[6-(2-hydroxytetradecylamino)hexylamino]tetradecan-2-ol
CID 21332395
1-(hexadecylamino)undecan-2-ol
CID 50915787
1-[7-(2-hydroxyheptylamino)heptylamino]heptan-2-ol
CID 21332422
1-[6-(2-hydroxyundecylamino)hexylamino]undecan-2-ol;dihydrobromide
CID 21332373
azane;2-ethyldodecanamide
CID 174462460
1-[6-(2-hydroxynonylamino)hexylamino]nonan-2-ol;bis(2-hydroxypropanoic acid)
CID 159703654
butanedioic acid;1-[6-(2-hydroxyundecylamino)hexylamino]undecan-2-ol
CID 21332461
1-(6-aminohexylamino)heptadecan-2-ol
CID 71383255
lithium;2-ethylhexanamide;hydride
CID 173043498
(2R)-1-[2-[[(2R)-2-hydroxydodecyl]amino]ethylamino]dodecan-2-ol
CID 25129899
2,9-dibutyldecanediamide
CID 141080467
1-(12-methyltridecylamino)undecan-2-ol
CID 87220932

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-8-(2-hydroxyhexylamino)octanamide?
The IUPAC name of 2-ethyl-8-(2-hydroxyhexylamino)octanamide (CID 88760259) is 2-ethyl-8-(2-hydroxyhexylamino)octanamide.
What is the SMILES notation for 2-ethyl-8-(2-hydroxyhexylamino)octanamide?
The canonical SMILES for 2-ethyl-8-(2-hydroxyhexylamino)octanamide is CCCCC(O)CNCCCCCCC(CC)C(N)=O.
What is the InChIKey of 2-ethyl-8-(2-hydroxyhexylamino)octanamide?
The InChIKey is PAFKFMDVIXXXME-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34N2O2/c1-3-5-11-15(19)13-18-12-9-7-6-8-10-14(4-2)16(17)20/h14-15,18-19H,3-13H2,1-2H3,(H2,17,20).
What are the key properties of 2-ethyl-8-(2-hydroxyhexylamino)octanamide?
2-ethyl-8-(2-hydroxyhexylamino)octanamide has a molecular weight of 286.46 g/mol, XLogP of 2.59, 14 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-8-(2-hydroxyhexylamino)octanamide is sourced from PubChem (CID 88760259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).