1-cyclohex-2-en-1-ylpiperidine-4-carboxamide

C12H20N2O — CID 171914153

IUPAC1-cyclohex-2-en-1-ylpiperidine-4-carboxamide
SMILESNC(=O)C1CCN(C2C=CCCC2)CC1
InChIInChI=1S/C12H20N2O/c13-12(15)10-6-8-14(9-7-10)11-4-2-1-3-5-11/h2,4,10-11H,1,3,5-9H2,(H2,13,15)
InChIKeyPBNGNVACLAVGQE-UHFFFAOYSA-N
MW208.30 g/mol
LogP1.29
Rot. Bonds2

About 1-cyclohex-2-en-1-ylpiperidine-4-carboxamide

1-cyclohex-2-en-1-ylpiperidine-4-carboxamide (PubChem CID 171914153) has the molecular formula C12H20N2O and a molecular weight of 208.30 g/mol. Its IUPAC name is 1-cyclohex-2-en-1-ylpiperidine-4-carboxamide.

Molecular Properties

Compound Name1-cyclohex-2-en-1-ylpiperidine-4-carboxamide
PubChem CID171914153
Molecular FormulaC12H20N2O
Molecular Weight208.30 g/mol
Exact Mass208.16
IUPAC Name1-cyclohex-2-en-1-ylpiperidine-4-carboxamide
SMILESNC(=O)C1CCN(C2C=CCCC2)CC1
InChIInChI=1S/C12H20N2O/c13-12(15)10-6-8-14(9-7-10)11-4-2-1-3-5-11/h2,4,10-11H,1,3,5-9H2,(H2,13,15)
InChIKeyPBNGNVACLAVGQE-UHFFFAOYSA-N
XLogP1.29
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.30
LogP ≤ 51.29
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 1-cyclohex-2-en-1-ylpiperidine-4-carboxamide?
The IUPAC name of 1-cyclohex-2-en-1-ylpiperidine-4-carboxamide (CID 171914153) is 1-cyclohex-2-en-1-ylpiperidine-4-carboxamide.
What is the SMILES notation for 1-cyclohex-2-en-1-ylpiperidine-4-carboxamide?
The canonical SMILES for 1-cyclohex-2-en-1-ylpiperidine-4-carboxamide is NC(=O)C1CCN(C2C=CCCC2)CC1.
What is the InChIKey of 1-cyclohex-2-en-1-ylpiperidine-4-carboxamide?
The InChIKey is PBNGNVACLAVGQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O/c13-12(15)10-6-8-14(9-7-10)11-4-2-1-3-5-11/h2,4,10-11H,1,3,5-9H2,(H2,13,15).
What are the key properties of 1-cyclohex-2-en-1-ylpiperidine-4-carboxamide?
1-cyclohex-2-en-1-ylpiperidine-4-carboxamide has a molecular weight of 208.30 g/mol, XLogP of 1.29, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohex-2-en-1-ylpiperidine-4-carboxamide is sourced from PubChem (CID 171914153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).