4-piperidin-1-ylcyclohex-2-en-1-amine

C11H20N2 — CID 126490183

IUPAC4-piperidin-1-ylcyclohex-2-en-1-amine
SMILESNC1C=CC(N2CCCCC2)CC1
InChIInChI=1S/C11H20N2/c12-10-4-6-11(7-5-10)13-8-2-1-3-9-13/h4,6,10-11H,1-3,5,7-9,12H2
InChIKeyBMSYQFHJIJLRLL-UHFFFAOYSA-N
MW180.30 g/mol
LogP1.52
Rot. Bonds1

About 4-piperidin-1-ylcyclohex-2-en-1-amine

4-piperidin-1-ylcyclohex-2-en-1-amine (PubChem CID 126490183) has the molecular formula C11H20N2 and a molecular weight of 180.30 g/mol. Its IUPAC name is 4-piperidin-1-ylcyclohex-2-en-1-amine.

Molecular Properties

Compound Name4-piperidin-1-ylcyclohex-2-en-1-amine
PubChem CID126490183
Molecular FormulaC11H20N2
Molecular Weight180.30 g/mol
Exact Mass180.16
IUPAC Name4-piperidin-1-ylcyclohex-2-en-1-amine
SMILESNC1C=CC(N2CCCCC2)CC1
InChIInChI=1S/C11H20N2/c12-10-4-6-11(7-5-10)13-8-2-1-3-9-13/h4,6,10-11H,1-3,5,7-9,12H2
InChIKeyBMSYQFHJIJLRLL-UHFFFAOYSA-N
XLogP1.52
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.30
LogP ≤ 51.52
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 4-piperidin-1-ylcyclohex-2-en-1-amine?
The IUPAC name of 4-piperidin-1-ylcyclohex-2-en-1-amine (CID 126490183) is 4-piperidin-1-ylcyclohex-2-en-1-amine.
What is the SMILES notation for 4-piperidin-1-ylcyclohex-2-en-1-amine?
The canonical SMILES for 4-piperidin-1-ylcyclohex-2-en-1-amine is NC1C=CC(N2CCCCC2)CC1.
What is the InChIKey of 4-piperidin-1-ylcyclohex-2-en-1-amine?
The InChIKey is BMSYQFHJIJLRLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2/c12-10-4-6-11(7-5-10)13-8-2-1-3-9-13/h4,6,10-11H,1-3,5,7-9,12H2.
What are the key properties of 4-piperidin-1-ylcyclohex-2-en-1-amine?
4-piperidin-1-ylcyclohex-2-en-1-amine has a molecular weight of 180.30 g/mol, XLogP of 1.52, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-piperidin-1-ylcyclohex-2-en-1-amine is sourced from PubChem (CID 126490183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).