1-(6-methylcyclohexa-1,5-dien-1-yl)piperidin-4-ol

C12H19NO — CID 173071099

IUPAC1-(6-methylcyclohexa-1,5-dien-1-yl)piperidin-4-ol
SMILESCC1=CCCC=C1N1CCC(O)CC1
InChIInChI=1S/C12H19NO/c1-10-4-2-3-5-12(10)13-8-6-11(14)7-9-13/h4-5,11,14H,2-3,6-9H2,1H3
InChIKeyXSNOZKBXYNKUME-UHFFFAOYSA-N
MW193.29 g/mol
LogP2.07
Rot. Bonds1

About 1-(6-methylcyclohexa-1,5-dien-1-yl)piperidin-4-ol

1-(6-methylcyclohexa-1,5-dien-1-yl)piperidin-4-ol (PubChem CID 173071099) has the molecular formula C12H19NO and a molecular weight of 193.29 g/mol. Its IUPAC name is 1-(6-methylcyclohexa-1,5-dien-1-yl)piperidin-4-ol.

Molecular Properties

Compound Name1-(6-methylcyclohexa-1,5-dien-1-yl)piperidin-4-ol
PubChem CID173071099
Molecular FormulaC12H19NO
Molecular Weight193.29 g/mol
Exact Mass193.15
IUPAC Name1-(6-methylcyclohexa-1,5-dien-1-yl)piperidin-4-ol
SMILESCC1=CCCC=C1N1CCC(O)CC1
InChIInChI=1S/C12H19NO/c1-10-4-2-3-5-12(10)13-8-6-11(14)7-9-13/h4-5,11,14H,2-3,6-9H2,1H3
InChIKeyXSNOZKBXYNKUME-UHFFFAOYSA-N
XLogP2.07
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(6-methylcyclohexa-1,5-dien-1-yl)piperidin-4-ol?
The IUPAC name of 1-(6-methylcyclohexa-1,5-dien-1-yl)piperidin-4-ol (CID 173071099) is 1-(6-methylcyclohexa-1,5-dien-1-yl)piperidin-4-ol.
What is the SMILES notation for 1-(6-methylcyclohexa-1,5-dien-1-yl)piperidin-4-ol?
The canonical SMILES for 1-(6-methylcyclohexa-1,5-dien-1-yl)piperidin-4-ol is CC1=CCCC=C1N1CCC(O)CC1.
What is the InChIKey of 1-(6-methylcyclohexa-1,5-dien-1-yl)piperidin-4-ol?
The InChIKey is XSNOZKBXYNKUME-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO/c1-10-4-2-3-5-12(10)13-8-6-11(14)7-9-13/h4-5,11,14H,2-3,6-9H2,1H3.
What are the key properties of 1-(6-methylcyclohexa-1,5-dien-1-yl)piperidin-4-ol?
1-(6-methylcyclohexa-1,5-dien-1-yl)piperidin-4-ol has a molecular weight of 193.29 g/mol, XLogP of 2.07, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-methylcyclohexa-1,5-dien-1-yl)piperidin-4-ol is sourced from PubChem (CID 173071099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).