1-cyclohexa-2,4-dien-1-ylpiperidine

C11H17N — CID 149419695

IUPAC1-cyclohexa-2,4-dien-1-ylpiperidine
SMILESC1=CCC(N2CCCCC2)C=C1
InChIInChI=1S/C11H17N/c1-3-7-11(8-4-1)12-9-5-2-6-10-12/h1,3-4,7,11H,2,5-6,8-10H2
InChIKeyYSXADIAJMUMEOO-UHFFFAOYSA-N
MW163.26 g/mol
LogP2.36
Rot. Bonds1

About 1-cyclohexa-2,4-dien-1-ylpiperidine

1-cyclohexa-2,4-dien-1-ylpiperidine (PubChem CID 149419695) has the molecular formula C11H17N and a molecular weight of 163.26 g/mol. Its IUPAC name is 1-cyclohexa-2,4-dien-1-ylpiperidine.

Molecular Properties

Compound Name1-cyclohexa-2,4-dien-1-ylpiperidine
PubChem CID149419695
Molecular FormulaC11H17N
Molecular Weight163.26 g/mol
Exact Mass163.14
IUPAC Name1-cyclohexa-2,4-dien-1-ylpiperidine
SMILESC1=CCC(N2CCCCC2)C=C1
InChIInChI=1S/C11H17N/c1-3-7-11(8-4-1)12-9-5-2-6-10-12/h1,3-4,7,11H,2,5-6,8-10H2
InChIKeyYSXADIAJMUMEOO-UHFFFAOYSA-N
XLogP2.36
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.26
LogP ≤ 52.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 16217258
[3-(1-Piperidinylmethyl)phenyl]magnesium bromide
CID 16217259
(4-(1-Piperidinylmethyl)phenyl)magnesium bromide
CID 16217260
1-(Cyclohex-2-en-1-yl)piperidine
CID 258780
1-(Cyclopent-2-en-1-yl)piperidine
CID 12296160
Piperidine, 1-(2,7-octadienyl)-
CID 4248884
Tetrahydro 2h quinolizin
CID 67020367
1-(1-Fluorocyclohexa-2,4-dien-1-yl)piperidine
CID 22637767
1-(1,6-Difluorocyclohexa-2,4-dien-1-yl)piperidine
CID 23123419
4-Fluoro-1-(4-propan-2-ylcyclohexa-2,4-dien-1-yl)piperidine
CID 134376304
1-[(2-Fluorocyclohexa-1,5-dien-1-yl)methyl]piperidine
CID 144302165
1-(Cyclohexa-1,5-dien-1-ylmethyl)-3-fluoro-1-methyl-4-methylidenepiperidin-1-ium
CID 157047690

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexa-2,4-dien-1-ylpiperidine?
The IUPAC name of 1-cyclohexa-2,4-dien-1-ylpiperidine (CID 149419695) is 1-cyclohexa-2,4-dien-1-ylpiperidine.
What is the SMILES notation for 1-cyclohexa-2,4-dien-1-ylpiperidine?
The canonical SMILES for 1-cyclohexa-2,4-dien-1-ylpiperidine is C1=CCC(N2CCCCC2)C=C1.
What is the InChIKey of 1-cyclohexa-2,4-dien-1-ylpiperidine?
The InChIKey is YSXADIAJMUMEOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N/c1-3-7-11(8-4-1)12-9-5-2-6-10-12/h1,3-4,7,11H,2,5-6,8-10H2.
What are the key properties of 1-cyclohexa-2,4-dien-1-ylpiperidine?
1-cyclohexa-2,4-dien-1-ylpiperidine has a molecular weight of 163.26 g/mol, XLogP of 2.36, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexa-2,4-dien-1-ylpiperidine is sourced from PubChem (CID 149419695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).