4-amino-1,6-dimethylcyclohex-3-en-1-ol

C8H15NO — CID 163725361

IUPAC4-amino-1,6-dimethylcyclohex-3-en-1-ol
SMILESCC1CC(N)=CCC1(C)O
InChIInChI=1S/C8H15NO/c1-6-5-7(9)3-4-8(6,2)10/h3,6,10H,4-5,9H2,1-2H3
InChIKeyKVBOMOVDFTUDGL-UHFFFAOYSA-N
MW141.21 g/mol
LogP1.01
Rot. Bonds

About 4-amino-1,6-dimethylcyclohex-3-en-1-ol

4-amino-1,6-dimethylcyclohex-3-en-1-ol (PubChem CID 163725361) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is 4-amino-1,6-dimethylcyclohex-3-en-1-ol.

Molecular Properties

Compound Name4-amino-1,6-dimethylcyclohex-3-en-1-ol
PubChem CID163725361
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name4-amino-1,6-dimethylcyclohex-3-en-1-ol
SMILESCC1CC(N)=CCC1(C)O
InChIInChI=1S/C8H15NO/c1-6-5-7(9)3-4-8(6,2)10/h3,6,10H,4-5,9H2,1-2H3
InChIKeyKVBOMOVDFTUDGL-UHFFFAOYSA-N
XLogP1.01
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 51.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(1R)-4-amino-1-methylcyclohex-3-en-1-ol
CID 132123377
(6R)-4-amino-6-ethylcyclohexa-1,3-dien-1-ol
CID 155216895
2-[(5S)-4-amino-1,5-dimethylcyclohex-3-en-1-yl]propan-2-ol
CID 164154528
Cyclohexen-1-amine;2,3-dimethylbutan-2-ol
CID 169199701
2,3-Dimethylbutan-2-ol;spiro[2.5]oct-6-en-6-amine
CID 169199888

Frequently Asked Questions

What is the IUPAC name of 4-amino-1,6-dimethylcyclohex-3-en-1-ol?
The IUPAC name of 4-amino-1,6-dimethylcyclohex-3-en-1-ol (CID 163725361) is 4-amino-1,6-dimethylcyclohex-3-en-1-ol.
What is the SMILES notation for 4-amino-1,6-dimethylcyclohex-3-en-1-ol?
The canonical SMILES for 4-amino-1,6-dimethylcyclohex-3-en-1-ol is CC1CC(N)=CCC1(C)O.
What is the InChIKey of 4-amino-1,6-dimethylcyclohex-3-en-1-ol?
The InChIKey is KVBOMOVDFTUDGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO/c1-6-5-7(9)3-4-8(6,2)10/h3,6,10H,4-5,9H2,1-2H3.
What are the key properties of 4-amino-1,6-dimethylcyclohex-3-en-1-ol?
4-amino-1,6-dimethylcyclohex-3-en-1-ol has a molecular weight of 141.21 g/mol, XLogP of 1.01, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-1,6-dimethylcyclohex-3-en-1-ol is sourced from PubChem (CID 163725361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).