1-amino-2,6-dimethylcyclohexan-1-ol

C8H17NO — CID 176657357

IUPAC1-amino-2,6-dimethylcyclohexan-1-ol
SMILESCC1CCCC(C)C1(N)O
InChIInChI=1S/C8H17NO/c1-6-4-3-5-7(2)8(6,9)10/h6-7,10H,3-5,9H2,1-2H3
InChIKeyNYDXROLQDHAQID-UHFFFAOYSA-N
MW143.23 g/mol
LogP1.09
Rot. Bonds

About 1-amino-2,6-dimethylcyclohexan-1-ol

1-amino-2,6-dimethylcyclohexan-1-ol (PubChem CID 176657357) has the molecular formula C8H17NO and a molecular weight of 143.23 g/mol. Its IUPAC name is 1-amino-2,6-dimethylcyclohexan-1-ol.

Molecular Properties

Compound Name1-amino-2,6-dimethylcyclohexan-1-ol
PubChem CID176657357
Molecular FormulaC8H17NO
Molecular Weight143.23 g/mol
Exact Mass143.13
IUPAC Name1-amino-2,6-dimethylcyclohexan-1-ol
SMILESCC1CCCC(C)C1(N)O
InChIInChI=1S/C8H17NO/c1-6-4-3-5-7(2)8(6,9)10/h6-7,10H,3-5,9H2,1-2H3
InChIKeyNYDXROLQDHAQID-UHFFFAOYSA-N
XLogP1.09
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
LogP ≤ 51.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

1-ethyl-2,6-dimethylcyclohexan-1-ol
CID 86221800
2,6-dimethyl-1-(trifluoromethyl)cyclohexan-1-amine
CID 63897712
1-(aminomethyl)-2,7-dimethylcycloheptan-1-ol
CID 83905899
trans-(1R,2S)-1,2-dimethylcyclopentan-1-ol
CID 13057535
1-(2-aminoethyl)-2,7-dimethylcycloheptan-1-ol
CID 83906952
1,2-dimethylcyclopentan-1-amine;hydrochloride
CID 146050243
trans-(1S,3S)-2,2,3-trimethylcyclohexan-1-amine
CID 96559139
cis-(1R,2S)-1-(aminomethyl)-2-methylcyclohexan-1-ol
CID 93046973
(2S,6S)-2,6-dimethylpiperidin-1-ium
CID 6560360
1-hydroxy-2,7-dimethylcycloheptane-1-carboxylic acid
CID 83906995
carbonic acid;1,2-dimethylcyclohexan-1-amine
CID 173050882
2-methylcyclopropane-1,1-diol
CID 68932442

Frequently Asked Questions

What is the IUPAC name of 1-amino-2,6-dimethylcyclohexan-1-ol?
The IUPAC name of 1-amino-2,6-dimethylcyclohexan-1-ol (CID 176657357) is 1-amino-2,6-dimethylcyclohexan-1-ol.
What is the SMILES notation for 1-amino-2,6-dimethylcyclohexan-1-ol?
The canonical SMILES for 1-amino-2,6-dimethylcyclohexan-1-ol is CC1CCCC(C)C1(N)O.
What is the InChIKey of 1-amino-2,6-dimethylcyclohexan-1-ol?
The InChIKey is NYDXROLQDHAQID-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO/c1-6-4-3-5-7(2)8(6,9)10/h6-7,10H,3-5,9H2,1-2H3.
What are the key properties of 1-amino-2,6-dimethylcyclohexan-1-ol?
1-amino-2,6-dimethylcyclohexan-1-ol has a molecular weight of 143.23 g/mol, XLogP of 1.09, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-2,6-dimethylcyclohexan-1-ol is sourced from PubChem (CID 176657357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).