6-amino-4-ethyl-2-methylhexan-2-ol

C9H21NO — CID 146359266

IUPAC6-amino-4-ethyl-2-methylhexan-2-ol
SMILESCCC(CCN)CC(C)(C)O
InChIInChI=1S/C9H21NO/c1-4-8(5-6-10)7-9(2,3)11/h8,11H,4-7,10H2,1-3H3
InChIKeyGUFZKRCHYDTEMQ-UHFFFAOYSA-N
MW159.27 g/mol
LogP1.52
Rot. Bonds5

About 6-amino-4-ethyl-2-methylhexan-2-ol

6-amino-4-ethyl-2-methylhexan-2-ol (PubChem CID 146359266) has the molecular formula C9H21NO and a molecular weight of 159.27 g/mol. Its IUPAC name is 6-amino-4-ethyl-2-methylhexan-2-ol.

Molecular Properties

Compound Name6-amino-4-ethyl-2-methylhexan-2-ol
PubChem CID146359266
Molecular FormulaC9H21NO
Molecular Weight159.27 g/mol
Exact Mass159.16
IUPAC Name6-amino-4-ethyl-2-methylhexan-2-ol
SMILESCCC(CCN)CC(C)(C)O
InChIInChI=1S/C9H21NO/c1-4-8(5-6-10)7-9(2,3)11/h8,11H,4-7,10H2,1-3H3
InChIKeyGUFZKRCHYDTEMQ-UHFFFAOYSA-N
XLogP1.52
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.27
LogP ≤ 51.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-ethyl-5,5-dimethylhexan-1-amine
CID 83682161
6-amino-4-ethyl-N-(2-hydroxy-2-methylpropyl)-N-methylhexanamide
CID 79379037
5-amino-3-(aminomethyl)-2-methylpentan-2-ol
CID 173461843
6-amino-4-ethyl-N-(2-hydroxy-2-methylbutyl)hexanamide
CID 65106452
(4S)-5-amino-2,4-dimethylpentan-2-ol
CID 97010229
5-amino-2,4-dimethylpentan-2-ol
CID 83681746
8-amino-6-ethyloctan-3-one
CID 116578085
2,6-diaminohexane-2,4-diol
CID 90758959
(3R)-3-ethylnonan-1-amine
CID 163925868
(3R,6R)-3-ethyl-6,7-dimethyloctan-1-amine
CID 163936645
3-ethyl-4,4-dimethylpentan-1-amine
CID 134419150
3-ethyl-4-methylpentan-1-amine
CID 91459106

Frequently Asked Questions

What is the IUPAC name of 6-amino-4-ethyl-2-methylhexan-2-ol?
The IUPAC name of 6-amino-4-ethyl-2-methylhexan-2-ol (CID 146359266) is 6-amino-4-ethyl-2-methylhexan-2-ol.
What is the SMILES notation for 6-amino-4-ethyl-2-methylhexan-2-ol?
The canonical SMILES for 6-amino-4-ethyl-2-methylhexan-2-ol is CCC(CCN)CC(C)(C)O.
What is the InChIKey of 6-amino-4-ethyl-2-methylhexan-2-ol?
The InChIKey is GUFZKRCHYDTEMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21NO/c1-4-8(5-6-10)7-9(2,3)11/h8,11H,4-7,10H2,1-3H3.
What are the key properties of 6-amino-4-ethyl-2-methylhexan-2-ol?
6-amino-4-ethyl-2-methylhexan-2-ol has a molecular weight of 159.27 g/mol, XLogP of 1.52, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-4-ethyl-2-methylhexan-2-ol is sourced from PubChem (CID 146359266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).