4-cyclohexa-2,4-dien-1-ylpiperidin-4-ol

C11H17NO — CID 89109775

IUPAC4-cyclohexa-2,4-dien-1-ylpiperidin-4-ol
SMILESOC1(C2C=CC=CC2)CCNCC1
InChIInChI=1S/C11H17NO/c13-11(6-8-12-9-7-11)10-4-2-1-3-5-10/h1-4,10,12-13H,5-9H2
InChIKeyKLVAWWZLSBJEQS-UHFFFAOYSA-N
MW179.26 g/mol
LogP1.23
Rot. Bonds1

About 4-cyclohexa-2,4-dien-1-ylpiperidin-4-ol

4-cyclohexa-2,4-dien-1-ylpiperidin-4-ol (PubChem CID 89109775) has the molecular formula C11H17NO and a molecular weight of 179.26 g/mol. Its IUPAC name is 4-cyclohexa-2,4-dien-1-ylpiperidin-4-ol.

Molecular Properties

Compound Name4-cyclohexa-2,4-dien-1-ylpiperidin-4-ol
PubChem CID89109775
Molecular FormulaC11H17NO
Molecular Weight179.26 g/mol
Exact Mass179.13
IUPAC Name4-cyclohexa-2,4-dien-1-ylpiperidin-4-ol
SMILESOC1(C2C=CC=CC2)CCNCC1
InChIInChI=1S/C11H17NO/c13-11(6-8-12-9-7-11)10-4-2-1-3-5-10/h1-4,10,12-13H,5-9H2
InChIKeyKLVAWWZLSBJEQS-UHFFFAOYSA-N
XLogP1.23
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.26
LogP ≤ 51.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-cyclohexa-2,4-dien-1-ylpiperidin-4-ol?
The IUPAC name of 4-cyclohexa-2,4-dien-1-ylpiperidin-4-ol (CID 89109775) is 4-cyclohexa-2,4-dien-1-ylpiperidin-4-ol.
What is the SMILES notation for 4-cyclohexa-2,4-dien-1-ylpiperidin-4-ol?
The canonical SMILES for 4-cyclohexa-2,4-dien-1-ylpiperidin-4-ol is OC1(C2C=CC=CC2)CCNCC1.
What is the InChIKey of 4-cyclohexa-2,4-dien-1-ylpiperidin-4-ol?
The InChIKey is KLVAWWZLSBJEQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO/c13-11(6-8-12-9-7-11)10-4-2-1-3-5-10/h1-4,10,12-13H,5-9H2.
What are the key properties of 4-cyclohexa-2,4-dien-1-ylpiperidin-4-ol?
4-cyclohexa-2,4-dien-1-ylpiperidin-4-ol has a molecular weight of 179.26 g/mol, XLogP of 1.23, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclohexa-2,4-dien-1-ylpiperidin-4-ol is sourced from PubChem (CID 89109775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).