3,3,5,5-tetramethyl-1-(methylamino)hexan-2-ol

C11H25NO — CID 135134903

IUPAC3,3,5,5-tetramethyl-1-(methylamino)hexan-2-ol
SMILESCNCC(O)C(C)(C)CC(C)(C)C
InChIInChI=1S/C11H25NO/c1-10(2,3)8-11(4,5)9(13)7-12-6/h9,12-13H,7-8H2,1-6H3
InChIKeyDNBMDFBQWNMGNU-UHFFFAOYSA-N
MW187.33 g/mol
LogP2.03
Rot. Bonds4

About 3,3,5,5-tetramethyl-1-(methylamino)hexan-2-ol

3,3,5,5-tetramethyl-1-(methylamino)hexan-2-ol (PubChem CID 135134903) has the molecular formula C11H25NO and a molecular weight of 187.33 g/mol. Its IUPAC name is 3,3,5,5-tetramethyl-1-(methylamino)hexan-2-ol.

Molecular Properties

Compound Name3,3,5,5-tetramethyl-1-(methylamino)hexan-2-ol
PubChem CID135134903
Molecular FormulaC11H25NO
Molecular Weight187.33 g/mol
Exact Mass187.19
IUPAC Name3,3,5,5-tetramethyl-1-(methylamino)hexan-2-ol
SMILESCNCC(O)C(C)(C)CC(C)(C)C
InChIInChI=1S/C11H25NO/c1-10(2,3)8-11(4,5)9(13)7-12-6/h9,12-13H,7-8H2,1-6H3
InChIKeyDNBMDFBQWNMGNU-UHFFFAOYSA-N
XLogP2.03
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
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 3,3,5,5-tetramethyl-1-(methylamino)hexan-2-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

3,3-dimethyl-1-(methylamino)butan-2-ol
CID 15635078
(2S,3S)-1,4-bis(methylamino)butane-2,3-diol
CID 100939749
1-(tert-butylamino)-2-(methylamino)ethanol
CID 166823664
1,1,1-trifluoro-3-(2,4,4-trimethylpentan-2-ylamino)propan-2-ol
CID 63900457
2,2,4,4,6,6,8,8-octamethylnonane-1,5-diol
CID 91435713
4,4-dimethyl-2-(methylaminomethyl)pentan-1-ol
CID 117241786
1-[2-methoxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]-2-(methylamino)ethanol
CID 117473718
2-chloro-N,4,4-trimethylpentan-1-amine
CID 107155762
1-amino-3-methyl-3-(methylamino)butan-2-ol
CID 139754066
2,2,7,7-tetramethyloctane-4,4,5-triol
CID 87646657
2-methoxy-N,5,5-trimethylhexan-1-amine
CID 177141375
3,3,5,5-tetramethylhexan-2-amine
CID 143433307

Frequently Asked Questions

What is the IUPAC name of 3,3,5,5-tetramethyl-1-(methylamino)hexan-2-ol?
The IUPAC name of 3,3,5,5-tetramethyl-1-(methylamino)hexan-2-ol (CID 135134903) is 3,3,5,5-tetramethyl-1-(methylamino)hexan-2-ol.
What is the SMILES notation for 3,3,5,5-tetramethyl-1-(methylamino)hexan-2-ol?
The canonical SMILES for 3,3,5,5-tetramethyl-1-(methylamino)hexan-2-ol is CNCC(O)C(C)(C)CC(C)(C)C.
What is the InChIKey of 3,3,5,5-tetramethyl-1-(methylamino)hexan-2-ol?
The InChIKey is DNBMDFBQWNMGNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25NO/c1-10(2,3)8-11(4,5)9(13)7-12-6/h9,12-13H,7-8H2,1-6H3.
What are the key properties of 3,3,5,5-tetramethyl-1-(methylamino)hexan-2-ol?
3,3,5,5-tetramethyl-1-(methylamino)hexan-2-ol has a molecular weight of 187.33 g/mol, XLogP of 2.03, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3,5,5-tetramethyl-1-(methylamino)hexan-2-ol is sourced from PubChem (CID 135134903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).