2-cyclohex-3-en-1-yloxyethanamine

C8H15NO — CID 89197318

IUPAC2-cyclohex-3-en-1-yloxyethanamine
SMILESNCCOC1CC=CCC1
InChIInChI=1S/C8H15NO/c9-6-7-10-8-4-2-1-3-5-8/h1-2,8H,3-7,9H2
InChIKeyUTNLZBKYGSQGSW-UHFFFAOYSA-N
MW141.21 g/mol
LogP1.07
Rot. Bonds3

About 2-cyclohex-3-en-1-yloxyethanamine

2-cyclohex-3-en-1-yloxyethanamine (PubChem CID 89197318) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is 2-cyclohex-3-en-1-yloxyethanamine.

Molecular Properties

Compound Name2-cyclohex-3-en-1-yloxyethanamine
PubChem CID89197318
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name2-cyclohex-3-en-1-yloxyethanamine
SMILESNCCOC1CC=CCC1
InChIInChI=1S/C8H15NO/c9-6-7-10-8-4-2-1-3-5-8/h1-2,8H,3-7,9H2
InChIKeyUTNLZBKYGSQGSW-UHFFFAOYSA-N
XLogP1.07
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 51.07
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-yloxyethanamine?
The IUPAC name of 2-cyclohex-3-en-1-yloxyethanamine (CID 89197318) is 2-cyclohex-3-en-1-yloxyethanamine.
What is the SMILES notation for 2-cyclohex-3-en-1-yloxyethanamine?
The canonical SMILES for 2-cyclohex-3-en-1-yloxyethanamine is NCCOC1CC=CCC1.
What is the InChIKey of 2-cyclohex-3-en-1-yloxyethanamine?
The InChIKey is UTNLZBKYGSQGSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO/c9-6-7-10-8-4-2-1-3-5-8/h1-2,8H,3-7,9H2.
What are the key properties of 2-cyclohex-3-en-1-yloxyethanamine?
2-cyclohex-3-en-1-yloxyethanamine has a molecular weight of 141.21 g/mol, XLogP of 1.07, 3 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-yloxyethanamine is sourced from PubChem (CID 89197318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).