2-amino-2,4,5,5-tetramethylhexan-3-ol

C10H23NO — CID 130506923

IUPAC2-amino-2,4,5,5-tetramethylhexan-3-ol
SMILESCC(C(O)C(C)(C)N)C(C)(C)C
InChIInChI=1S/C10H23NO/c1-7(9(2,3)4)8(12)10(5,6)11/h7-8,12H,11H2,1-6H3
InChIKeyKOMRKFTYQPIUDD-UHFFFAOYSA-N
MW173.30 g/mol
LogP1.77
Rot. Bonds2

About 2-amino-2,4,5,5-tetramethylhexan-3-ol

2-amino-2,4,5,5-tetramethylhexan-3-ol (PubChem CID 130506923) has the molecular formula C10H23NO and a molecular weight of 173.30 g/mol. Its IUPAC name is 2-amino-2,4,5,5-tetramethylhexan-3-ol.

Molecular Properties

Compound Name2-amino-2,4,5,5-tetramethylhexan-3-ol
PubChem CID130506923
Molecular FormulaC10H23NO
Molecular Weight173.30 g/mol
Exact Mass173.18
IUPAC Name2-amino-2,4,5,5-tetramethylhexan-3-ol
SMILESCC(C(O)C(C)(C)N)C(C)(C)C
InChIInChI=1S/C10H23NO/c1-7(9(2,3)4)8(12)10(5,6)11/h7-8,12H,11H2,1-6H3
InChIKeyKOMRKFTYQPIUDD-UHFFFAOYSA-N
XLogP1.77
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.30
LogP ≤ 51.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-amino-2,4,5,5-tetramethylhexan-3-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

4-amino-2,3,4-trimethylpentan-2-ol
CID 146264907
(3R)-2-amino-3,4,4-trimethylpentan-2-ol
CID 139473324
(2R,3S)-3,4,4-trimethylpentan-2-ol
CID 58403064
2,2,3,5,5-pentamethylheptan-4-ol
CID 156689812
(2S)-1-aminopropane-1,1,2-triol
CID 25141054
3,4,5-trimethylhexane-2,3-diol
CID 67159638
3-tert-butyl-4,4-dimethylpentan-2-ol
CID 59805518
(2S)-2-amino-3-hydroxy-2,4-dimethylpentanoic acid
CID 45086732
(3S,4R)-3-amino-4-hydroxy-3,5-dimethylhexan-2-one
CID 158269541
1-amino-1-(1-hydroxyethylamino)ethanol
CID 57311294
methanol;2-methylpropan-2-ol;bis(propan-2-ol)
CID 173031794
2,2,5-trimethylhexane-3,4-diol
CID 103456431

Frequently Asked Questions

What is the IUPAC name of 2-amino-2,4,5,5-tetramethylhexan-3-ol?
The IUPAC name of 2-amino-2,4,5,5-tetramethylhexan-3-ol (CID 130506923) is 2-amino-2,4,5,5-tetramethylhexan-3-ol.
What is the SMILES notation for 2-amino-2,4,5,5-tetramethylhexan-3-ol?
The canonical SMILES for 2-amino-2,4,5,5-tetramethylhexan-3-ol is CC(C(O)C(C)(C)N)C(C)(C)C.
What is the InChIKey of 2-amino-2,4,5,5-tetramethylhexan-3-ol?
The InChIKey is KOMRKFTYQPIUDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NO/c1-7(9(2,3)4)8(12)10(5,6)11/h7-8,12H,11H2,1-6H3.
What are the key properties of 2-amino-2,4,5,5-tetramethylhexan-3-ol?
2-amino-2,4,5,5-tetramethylhexan-3-ol has a molecular weight of 173.30 g/mol, XLogP of 1.77, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2,4,5,5-tetramethylhexan-3-ol is sourced from PubChem (CID 130506923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).