3-(diethylamino)-3,6-diethyldecan-4-ol

C18H39NO — CID 79061528

IUPAC3-(diethylamino)-3,6-diethyldecan-4-ol
SMILESCCCCC(CC)CC(O)C(CC)(CC)N(CC)CC
InChIInChI=1S/C18H39NO/c1-7-13-14-16(8-2)15-17(20)18(9-3,10-4)19(11-5)12-6/h16-17,20H,7-15H2,1-6H3
InChIKeyYZUWVKUZWQNVQF-UHFFFAOYSA-N
MW285.52 g/mol
LogP4.85
Rot. Bonds12

About 3-(diethylamino)-3,6-diethyldecan-4-ol

3-(diethylamino)-3,6-diethyldecan-4-ol (PubChem CID 79061528) has the molecular formula C18H39NO and a molecular weight of 285.52 g/mol. Its IUPAC name is 3-(diethylamino)-3,6-diethyldecan-4-ol.

Molecular Properties

Compound Name3-(diethylamino)-3,6-diethyldecan-4-ol
PubChem CID79061528
Molecular FormulaC18H39NO
Molecular Weight285.52 g/mol
Exact Mass285.30
IUPAC Name3-(diethylamino)-3,6-diethyldecan-4-ol
SMILESCCCCC(CC)CC(O)C(CC)(CC)N(CC)CC
InChIInChI=1S/C18H39NO/c1-7-13-14-16(8-2)15-17(20)18(9-3,10-4)19(11-5)12-6/h16-17,20H,7-15H2,1-6H3
InChIKeyYZUWVKUZWQNVQF-UHFFFAOYSA-N
XLogP4.85
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds12
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.52
LogP ≤ 54.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6-ethyl-3,3-dimethyldecan-4-ol
CID 114981382
5,11-diethyl-8,8-dimethylpentadecane-7,9-diol
CID 140569222
(2R,4S)-4-ethyloctan-2-ol
CID 7015159
3-N,3-N,3-triethyloctane-3,4-diamine
CID 79061661
3-(diethylamino)-3-ethyl-8,8,8-trifluorooctan-4-ol
CID 115516163
5-ethylnonane-2,3-diol
CID 87935287
(5S)-3,5-diethylnonane;methane
CID 159387669
(6R,9R)-3,9-diethyltridecan-6-ol
CID 86308442
5,9-diethyl-7-(2-ethylpentyl)tridecane
CID 170533070
3-tert-butyl-5-ethyl-2,2-dimethylnonane;ethane
CID 143303166
6-ethyldecane-1,4-diol
CID 106677709
6-ethyl-2,3-dimethyldecan-4-ol
CID 114981252

Frequently Asked Questions

What is the IUPAC name of 3-(diethylamino)-3,6-diethyldecan-4-ol?
The IUPAC name of 3-(diethylamino)-3,6-diethyldecan-4-ol (CID 79061528) is 3-(diethylamino)-3,6-diethyldecan-4-ol.
What is the SMILES notation for 3-(diethylamino)-3,6-diethyldecan-4-ol?
The canonical SMILES for 3-(diethylamino)-3,6-diethyldecan-4-ol is CCCCC(CC)CC(O)C(CC)(CC)N(CC)CC.
What is the InChIKey of 3-(diethylamino)-3,6-diethyldecan-4-ol?
The InChIKey is YZUWVKUZWQNVQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H39NO/c1-7-13-14-16(8-2)15-17(20)18(9-3,10-4)19(11-5)12-6/h16-17,20H,7-15H2,1-6H3.
What are the key properties of 3-(diethylamino)-3,6-diethyldecan-4-ol?
3-(diethylamino)-3,6-diethyldecan-4-ol has a molecular weight of 285.52 g/mol, XLogP of 4.85, 12 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(diethylamino)-3,6-diethyldecan-4-ol is sourced from PubChem (CID 79061528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).