5-(methylaminomethyl)cyclohex-2-en-1-ol

C8H15NO — CID 14737758

IUPAC5-(methylaminomethyl)cyclohex-2-en-1-ol
SMILESCNCC1CC=CC(O)C1
InChIInChI=1S/C8H15NO/c1-9-6-7-3-2-4-8(10)5-7/h2,4,7-10H,3,5-6H2,1H3
InChIKeyUBYCTJSHTVOZBB-UHFFFAOYSA-N
MW141.21 g/mol
LogP0.53
Rot. Bonds2

About 5-(methylaminomethyl)cyclohex-2-en-1-ol

5-(methylaminomethyl)cyclohex-2-en-1-ol (PubChem CID 14737758) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is 5-(methylaminomethyl)cyclohex-2-en-1-ol.

Molecular Properties

Compound Name5-(methylaminomethyl)cyclohex-2-en-1-ol
PubChem CID14737758
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name5-(methylaminomethyl)cyclohex-2-en-1-ol
SMILESCNCC1CC=CC(O)C1
InChIInChI=1S/C8H15NO/c1-9-6-7-3-2-4-8(10)5-7/h2,4,7-10H,3,5-6H2,1H3
InChIKeyUBYCTJSHTVOZBB-UHFFFAOYSA-N
XLogP0.53
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 50.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-(methylaminomethyl)cyclohex-2-en-1-ol?
The IUPAC name of 5-(methylaminomethyl)cyclohex-2-en-1-ol (CID 14737758) is 5-(methylaminomethyl)cyclohex-2-en-1-ol.
What is the SMILES notation for 5-(methylaminomethyl)cyclohex-2-en-1-ol?
The canonical SMILES for 5-(methylaminomethyl)cyclohex-2-en-1-ol is CNCC1CC=CC(O)C1.
What is the InChIKey of 5-(methylaminomethyl)cyclohex-2-en-1-ol?
The InChIKey is UBYCTJSHTVOZBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO/c1-9-6-7-3-2-4-8(10)5-7/h2,4,7-10H,3,5-6H2,1H3.
What are the key properties of 5-(methylaminomethyl)cyclohex-2-en-1-ol?
5-(methylaminomethyl)cyclohex-2-en-1-ol has a molecular weight of 141.21 g/mol, XLogP of 0.53, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(methylaminomethyl)cyclohex-2-en-1-ol is sourced from PubChem (CID 14737758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).