cyclohex-2-en-1-one;piperidine

C11H19NO — CID 163560631

IUPACcyclohex-2-en-1-one;piperidine
SMILESC1CCNCC1.O=C1C=CCCC1
InChIInChI=1S/C6H8O.C5H11N/c7-6-4-2-1-3-5-6;1-2-4-6-5-3-1/h2,4H,1,3,5H2;6H,1-5H2
InChIKeyFQXQQECHEMHOAP-UHFFFAOYSA-N
MW181.28 g/mol
LogP2.06
Rot. Bonds

About cyclohex-2-en-1-one;piperidine

cyclohex-2-en-1-one;piperidine (PubChem CID 163560631) has the molecular formula C11H19NO and a molecular weight of 181.28 g/mol. Its IUPAC name is cyclohex-2-en-1-one;piperidine.

Molecular Properties

Compound Namecyclohex-2-en-1-one;piperidine
PubChem CID163560631
Molecular FormulaC11H19NO
Molecular Weight181.28 g/mol
Exact Mass181.15
IUPAC Namecyclohex-2-en-1-one;piperidine
SMILESC1CCNCC1.O=C1C=CCCC1
InChIInChI=1S/C6H8O.C5H11N/c7-6-4-2-1-3-5-6;1-2-4-6-5-3-1/h2,4H,1,3,5H2;6H,1-5H2
InChIKeyFQXQQECHEMHOAP-UHFFFAOYSA-N
XLogP2.06
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.28
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

cyclohex-2-en-1-one;dihydrochloride
CID 21391808
CID 68518361
CID 68518361
(2E)-cyclooct-2-en-1-one
CID 12579018
(2Z,7Z)-cyclononadeca-2,7-diene-1,9-dione
CID 23567733
(2E,8E)-cycloicosa-2,8-diene-1,10-dione
CID 10149582
(9E,21E)-cyclodocosa-9,21-diene-1,8-dione
CID 10193416
(2E)-cyclononadec-2-en-1-one
CID 171377738
(2E,6E)-cyclooctadeca-2,6-diene-1,8-dione
CID 58620253
(2Z,6E)-cyclooctadeca-2,6-diene-1,8-dione
CID 23567736
(2Z,8E)-cycloundeca-2,8-dien-1-one
CID 171377468
(2Z,4Z,12Z,14Z)-cyclooctadeca-2,4,12,14-tetraen-1-one
CID 144676209
cyclohex-2-en-1-one;propanal
CID 19894625

Frequently Asked Questions

What is the IUPAC name of cyclohex-2-en-1-one;piperidine?
The IUPAC name of cyclohex-2-en-1-one;piperidine (CID 163560631) is cyclohex-2-en-1-one;piperidine.
What is the SMILES notation for cyclohex-2-en-1-one;piperidine?
The canonical SMILES for cyclohex-2-en-1-one;piperidine is C1CCNCC1.O=C1C=CCCC1.
What is the InChIKey of cyclohex-2-en-1-one;piperidine?
The InChIKey is FQXQQECHEMHOAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8O.C5H11N/c7-6-4-2-1-3-5-6;1-2-4-6-5-3-1/h2,4H,1,3,5H2;6H,1-5H2.
What are the key properties of cyclohex-2-en-1-one;piperidine?
cyclohex-2-en-1-one;piperidine has a molecular weight of 181.28 g/mol, XLogP of 2.06, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohex-2-en-1-one;piperidine is sourced from PubChem (CID 163560631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).