2-cyclohexa-1,3-dien-1-ylpiperidin-4-ol

C11H17NO — CID 89088824

IUPAC2-cyclohexa-1,3-dien-1-ylpiperidin-4-ol
SMILESOC1CCNC(C2=CC=CCC2)C1
InChIInChI=1S/C11H17NO/c13-10-6-7-12-11(8-10)9-4-2-1-3-5-9/h1-2,4,10-13H,3,5-8H2
InChIKeyGMWMCJXRJXJWFV-UHFFFAOYSA-N
MW179.26 g/mol
LogP1.38
Rot. Bonds1

About 2-cyclohexa-1,3-dien-1-ylpiperidin-4-ol

2-cyclohexa-1,3-dien-1-ylpiperidin-4-ol (PubChem CID 89088824) has the molecular formula C11H17NO and a molecular weight of 179.26 g/mol. Its IUPAC name is 2-cyclohexa-1,3-dien-1-ylpiperidin-4-ol.

Molecular Properties

Compound Name2-cyclohexa-1,3-dien-1-ylpiperidin-4-ol
PubChem CID89088824
Molecular FormulaC11H17NO
Molecular Weight179.26 g/mol
Exact Mass179.13
IUPAC Name2-cyclohexa-1,3-dien-1-ylpiperidin-4-ol
SMILESOC1CCNC(C2=CC=CCC2)C1
InChIInChI=1S/C11H17NO/c13-10-6-7-12-11(8-10)9-4-2-1-3-5-9/h1-2,4,10-13H,3,5-8H2
InChIKeyGMWMCJXRJXJWFV-UHFFFAOYSA-N
XLogP1.38
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 ≤ 51.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

Pseudodistomin D
CID 10708961
(2R,4R,5S)-5-amino-2-[(6E,8E)-trideca-6,8-dienyl]piperidin-4-ol
CID 6450518
(2R,4R)-2-[(1E,3E)-penta-1,3-dienyl]piperidin-4-ol
CID 10773405
(2S,4S)-2-[(1E,3E)-penta-1,3-dienyl]piperidin-4-ol
CID 10241170
Pseudodistomin E
CID 10424557
(2S,4R)-2-[(1E,3E)-penta-1,3-dienyl]piperidin-4-ol
CID 15071617
2-[(1E,3E)-penta-1,3-dienyl]piperidin-4-ol
CID 101290455
(2S,4S,5R)-5-amino-2-[(6E,8E)-trideca-6,8-dienyl]piperidin-4-ol
CID 162893519
(2S,4R,5R)-5-amino-2-[(6E,8E)-trideca-6,8-dienyl]piperidin-4-ol
CID 162893520
(2S,4R,5S)-5-amino-2-[(6E,8E)-trideca-6,8-dienyl]piperidin-4-ol
CID 162893521
(2R,4S)-2-[(1E,3E)-penta-1,3-dienyl]piperidin-4-ol
CID 11286679
(2R,4R,5S)-5-amino-2-[(6E,8Z)-trideca-6,8-dienyl]piperidin-4-ol
CID 11779245

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexa-1,3-dien-1-ylpiperidin-4-ol?
The IUPAC name of 2-cyclohexa-1,3-dien-1-ylpiperidin-4-ol (CID 89088824) is 2-cyclohexa-1,3-dien-1-ylpiperidin-4-ol.
What is the SMILES notation for 2-cyclohexa-1,3-dien-1-ylpiperidin-4-ol?
The canonical SMILES for 2-cyclohexa-1,3-dien-1-ylpiperidin-4-ol is OC1CCNC(C2=CC=CCC2)C1.
What is the InChIKey of 2-cyclohexa-1,3-dien-1-ylpiperidin-4-ol?
The InChIKey is GMWMCJXRJXJWFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO/c13-10-6-7-12-11(8-10)9-4-2-1-3-5-9/h1-2,4,10-13H,3,5-8H2.
What are the key properties of 2-cyclohexa-1,3-dien-1-ylpiperidin-4-ol?
2-cyclohexa-1,3-dien-1-ylpiperidin-4-ol has a molecular weight of 179.26 g/mol, XLogP of 1.38, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexa-1,3-dien-1-ylpiperidin-4-ol is sourced from PubChem (CID 89088824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).