2-cyclohex-3-en-1-yloxolan-3-amine

C10H17NO — CID 79365764

IUPAC2-cyclohex-3-en-1-yloxolan-3-amine
SMILESNC1CCOC1C1CC=CCC1
InChIInChI=1S/C10H17NO/c11-9-6-7-12-10(9)8-4-2-1-3-5-8/h1-2,8-10H,3-7,11H2
InChIKeyGFJSENMYDASUSV-UHFFFAOYSA-N
MW167.25 g/mol
LogP1.46
Rot. Bonds1

About 2-cyclohex-3-en-1-yloxolan-3-amine

2-cyclohex-3-en-1-yloxolan-3-amine (PubChem CID 79365764) has the molecular formula C10H17NO and a molecular weight of 167.25 g/mol. Its IUPAC name is 2-cyclohex-3-en-1-yloxolan-3-amine.

Molecular Properties

Compound Name2-cyclohex-3-en-1-yloxolan-3-amine
PubChem CID79365764
Molecular FormulaC10H17NO
Molecular Weight167.25 g/mol
Exact Mass167.13
IUPAC Name2-cyclohex-3-en-1-yloxolan-3-amine
SMILESNC1CCOC1C1CC=CCC1
InChIInChI=1S/C10H17NO/c11-9-6-7-12-10(9)8-4-2-1-3-5-8/h1-2,8-10H,3-7,11H2
InChIKeyGFJSENMYDASUSV-UHFFFAOYSA-N
XLogP1.46
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.25
LogP ≤ 51.46
H-Bond Donors ≤ 51
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 2-cyclohex-3-en-1-yloxolan-3-amine?
The IUPAC name of 2-cyclohex-3-en-1-yloxolan-3-amine (CID 79365764) is 2-cyclohex-3-en-1-yloxolan-3-amine.
What is the SMILES notation for 2-cyclohex-3-en-1-yloxolan-3-amine?
The canonical SMILES for 2-cyclohex-3-en-1-yloxolan-3-amine is NC1CCOC1C1CC=CCC1.
What is the InChIKey of 2-cyclohex-3-en-1-yloxolan-3-amine?
The InChIKey is GFJSENMYDASUSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO/c11-9-6-7-12-10(9)8-4-2-1-3-5-8/h1-2,8-10H,3-7,11H2.
What are the key properties of 2-cyclohex-3-en-1-yloxolan-3-amine?
2-cyclohex-3-en-1-yloxolan-3-amine has a molecular weight of 167.25 g/mol, XLogP of 1.46, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohex-3-en-1-yloxolan-3-amine is sourced from PubChem (CID 79365764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).