5,6-dimethyl-3-(methylamino)octan-4-ol

C11H25NO — CID 20658869

IUPAC5,6-dimethyl-3-(methylamino)octan-4-ol
SMILESCCC(C)C(C)C(O)C(CC)NC
InChIInChI=1S/C11H25NO/c1-6-8(3)9(4)11(13)10(7-2)12-5/h8-13H,6-7H2,1-5H3
InChIKeyARXIGHDCELWGTC-UHFFFAOYSA-N
MW187.33 g/mol
LogP2.03
Rot. Bonds6

About 5,6-dimethyl-3-(methylamino)octan-4-ol

5,6-dimethyl-3-(methylamino)octan-4-ol (PubChem CID 20658869) has the molecular formula C11H25NO and a molecular weight of 187.33 g/mol. Its IUPAC name is 5,6-dimethyl-3-(methylamino)octan-4-ol.

Molecular Properties

Compound Name5,6-dimethyl-3-(methylamino)octan-4-ol
PubChem CID20658869
Molecular FormulaC11H25NO
Molecular Weight187.33 g/mol
Exact Mass187.19
IUPAC Name5,6-dimethyl-3-(methylamino)octan-4-ol
SMILESCCC(C)C(C)C(O)C(CC)NC
InChIInChI=1S/C11H25NO/c1-6-8(3)9(4)11(13)10(7-2)12-5/h8-13H,6-7H2,1-5H3
InChIKeyARXIGHDCELWGTC-UHFFFAOYSA-N
XLogP2.03
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.33
LogP ≤ 52.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 5,6-dimethyl-3-(methylamino)octan-4-ol 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

1-Cyclohexyl-2-(methylamino)ethan-1-ol
CID 89518
2-[(4-Tert-butylcyclohexyl)amino]butan-1-ol
CID 2947542
2-Cyclohexyl-2-(methylamino)ethanol
CID 278542
(1R)-2-methyl-1-[(2S)-pyrrolidin-2-yl]propan-1-ol
CID 11217316
2-Methyl-1-(4-methylpyrrolidin-2-yl)propan-1-ol
CID 12032217
2-(Tert-butylamino)-1-cyclohexylethanol
CID 62772381
(s)-N-dodecyl leucinol
CID 129847200
(3R,4S,5S,6R)-6-ethyl-4,5-dimethylpiperidin-3-ol
CID 135009947
1-((6-Aminotrimethylhexyl)amino)propan-2-ol
CID 3023051
1-(2,8-Dimethylnonan-5-ylamino)propan-2-ol
CID 277025
Cyclopentyl(piperidin-2-yl)methanol
CID 10197963
2-Methyl-1-pyrrolidin-2-ylpropan-1-ol
CID 10290851

Frequently Asked Questions

What is the IUPAC name of 5,6-dimethyl-3-(methylamino)octan-4-ol?
The IUPAC name of 5,6-dimethyl-3-(methylamino)octan-4-ol (CID 20658869) is 5,6-dimethyl-3-(methylamino)octan-4-ol.
What is the SMILES notation for 5,6-dimethyl-3-(methylamino)octan-4-ol?
The canonical SMILES for 5,6-dimethyl-3-(methylamino)octan-4-ol is CCC(C)C(C)C(O)C(CC)NC.
What is the InChIKey of 5,6-dimethyl-3-(methylamino)octan-4-ol?
The InChIKey is ARXIGHDCELWGTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25NO/c1-6-8(3)9(4)11(13)10(7-2)12-5/h8-13H,6-7H2,1-5H3.
What are the key properties of 5,6-dimethyl-3-(methylamino)octan-4-ol?
5,6-dimethyl-3-(methylamino)octan-4-ol has a molecular weight of 187.33 g/mol, XLogP of 2.03, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dimethyl-3-(methylamino)octan-4-ol is sourced from PubChem (CID 20658869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).