4-(6-methoxycyclohex-2-en-1-yl)piperidine

C12H21NO — CID 142856374

IUPAC4-(6-methoxycyclohex-2-en-1-yl)piperidine
SMILESCOC1CCC=CC1C1CCNCC1
InChIInChI=1S/C12H21NO/c1-14-12-5-3-2-4-11(12)10-6-8-13-9-7-10/h2,4,10-13H,3,5-9H2,1H3
InChIKeyJWDVHWMFASDHDZ-UHFFFAOYSA-N
MW195.31 g/mol
LogP1.97
Rot. Bonds2

About 4-(6-methoxycyclohex-2-en-1-yl)piperidine

4-(6-methoxycyclohex-2-en-1-yl)piperidine (PubChem CID 142856374) has the molecular formula C12H21NO and a molecular weight of 195.31 g/mol. Its IUPAC name is 4-(6-methoxycyclohex-2-en-1-yl)piperidine.

Molecular Properties

Compound Name4-(6-methoxycyclohex-2-en-1-yl)piperidine
PubChem CID142856374
Molecular FormulaC12H21NO
Molecular Weight195.31 g/mol
Exact Mass195.16
IUPAC Name4-(6-methoxycyclohex-2-en-1-yl)piperidine
SMILESCOC1CCC=CC1C1CCNCC1
InChIInChI=1S/C12H21NO/c1-14-12-5-3-2-4-11(12)10-6-8-13-9-7-10/h2,4,10-13H,3,5-9H2,1H3
InChIKeyJWDVHWMFASDHDZ-UHFFFAOYSA-N
XLogP1.97
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.31
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze 4-(6-methoxycyclohex-2-en-1-yl)piperidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-(6-methoxycyclohex-2-en-1-yl)piperidine?
The IUPAC name of 4-(6-methoxycyclohex-2-en-1-yl)piperidine (CID 142856374) is 4-(6-methoxycyclohex-2-en-1-yl)piperidine.
What is the SMILES notation for 4-(6-methoxycyclohex-2-en-1-yl)piperidine?
The canonical SMILES for 4-(6-methoxycyclohex-2-en-1-yl)piperidine is COC1CCC=CC1C1CCNCC1.
What is the InChIKey of 4-(6-methoxycyclohex-2-en-1-yl)piperidine?
The InChIKey is JWDVHWMFASDHDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21NO/c1-14-12-5-3-2-4-11(12)10-6-8-13-9-7-10/h2,4,10-13H,3,5-9H2,1H3.
What are the key properties of 4-(6-methoxycyclohex-2-en-1-yl)piperidine?
4-(6-methoxycyclohex-2-en-1-yl)piperidine has a molecular weight of 195.31 g/mol, XLogP of 1.97, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-methoxycyclohex-2-en-1-yl)piperidine is sourced from PubChem (CID 142856374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).