cyclohex-2-en-1-amine

C6H11N — CID 10931371

IUPACcyclohex-2-en-1-amine
SMILESNC1C=CCCC1
InChIInChI=1S/C6H11N/c7-6-4-2-1-3-5-6/h2,4,6H,1,3,5,7H2
InChIKeyACYMGUSQXQEHGA-UHFFFAOYSA-N
MW97.16 g/mol
LogP1.05
Rot. Bonds

About cyclohex-2-en-1-amine

cyclohex-2-en-1-amine (PubChem CID 10931371) has the molecular formula C6H11N and a molecular weight of 97.16 g/mol. Its IUPAC name is cyclohex-2-en-1-amine.

Molecular Properties

Compound Namecyclohex-2-en-1-amine
PubChem CID10931371
Molecular FormulaC6H11N
Molecular Weight97.16 g/mol
Exact Mass97.09
IUPAC Namecyclohex-2-en-1-amine
SMILESNC1C=CCCC1
InChIInChI=1S/C6H11N/c7-6-4-2-1-3-5-6/h2,4,6H,1,3,5,7H2
InChIKeyACYMGUSQXQEHGA-UHFFFAOYSA-N
XLogP1.05
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50097.16
LogP ≤ 51.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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 cyclohex-2-en-1-amine?
The IUPAC name of cyclohex-2-en-1-amine (CID 10931371) is cyclohex-2-en-1-amine.
What is the SMILES notation for cyclohex-2-en-1-amine?
The canonical SMILES for cyclohex-2-en-1-amine is NC1C=CCCC1.
What is the InChIKey of cyclohex-2-en-1-amine?
The InChIKey is ACYMGUSQXQEHGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N/c7-6-4-2-1-3-5-6/h2,4,6H,1,3,5,7H2.
What are the key properties of cyclohex-2-en-1-amine?
cyclohex-2-en-1-amine has a molecular weight of 97.16 g/mol, XLogP of 1.05, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohex-2-en-1-amine is sourced from PubChem (CID 10931371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).