4-amino-2,2-dimethylcyclohexan-1-ol

C8H17NO — CID 21291621

IUPAC4-amino-2,2-dimethylcyclohexan-1-ol
SMILESCC1(C)CC(N)CCC1O
InChIInChI=1S/C8H17NO/c1-8(2)5-6(9)3-4-7(8)10/h6-7,10H,3-5,9H2,1-2H3
InChIKeyWZDISXGBYPFZIO-UHFFFAOYSA-N
MW143.23 g/mol
LogP0.88
Rot. Bonds

About 4-amino-2,2-dimethylcyclohexan-1-ol

4-amino-2,2-dimethylcyclohexan-1-ol (PubChem CID 21291621) has the molecular formula C8H17NO and a molecular weight of 143.23 g/mol. Its IUPAC name is 4-amino-2,2-dimethylcyclohexan-1-ol.

Molecular Properties

Compound Name4-amino-2,2-dimethylcyclohexan-1-ol
PubChem CID21291621
Molecular FormulaC8H17NO
Molecular Weight143.23 g/mol
Exact Mass143.13
IUPAC Name4-amino-2,2-dimethylcyclohexan-1-ol
SMILESCC1(C)CC(N)CCC1O
InChIInChI=1S/C8H17NO/c1-8(2)5-6(9)3-4-7(8)10/h6-7,10H,3-5,9H2,1-2H3
InChIKeyWZDISXGBYPFZIO-UHFFFAOYSA-N
XLogP0.88
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 ≤ 50.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-amino-2,2-dimethylcyclohexan-1-ol?
The IUPAC name of 4-amino-2,2-dimethylcyclohexan-1-ol (CID 21291621) is 4-amino-2,2-dimethylcyclohexan-1-ol.
What is the SMILES notation for 4-amino-2,2-dimethylcyclohexan-1-ol?
The canonical SMILES for 4-amino-2,2-dimethylcyclohexan-1-ol is CC1(C)CC(N)CCC1O.
What is the InChIKey of 4-amino-2,2-dimethylcyclohexan-1-ol?
The InChIKey is WZDISXGBYPFZIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO/c1-8(2)5-6(9)3-4-7(8)10/h6-7,10H,3-5,9H2,1-2H3.
What are the key properties of 4-amino-2,2-dimethylcyclohexan-1-ol?
4-amino-2,2-dimethylcyclohexan-1-ol has a molecular weight of 143.23 g/mol, XLogP of 0.88, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-2,2-dimethylcyclohexan-1-ol is sourced from PubChem (CID 21291621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).