1-(4-methylcyclohexa-2,4-dien-1-yl)piperidin-2-ol

C12H19NO — CID 163423969

IUPAC1-(4-methylcyclohexa-2,4-dien-1-yl)piperidin-2-ol
SMILESCC1=CCC(N2CCCCC2O)C=C1
InChIInChI=1S/C12H19NO/c1-10-5-7-11(8-6-10)13-9-3-2-4-12(13)14/h5-7,11-12,14H,2-4,8-9H2,1H3
InChIKeyAKWQDWXCVVIGJA-UHFFFAOYSA-N
MW193.29 g/mol
LogP2.07
Rot. Bonds1

About 1-(4-methylcyclohexa-2,4-dien-1-yl)piperidin-2-ol

1-(4-methylcyclohexa-2,4-dien-1-yl)piperidin-2-ol (PubChem CID 163423969) has the molecular formula C12H19NO and a molecular weight of 193.29 g/mol. Its IUPAC name is 1-(4-methylcyclohexa-2,4-dien-1-yl)piperidin-2-ol.

Molecular Properties

Compound Name1-(4-methylcyclohexa-2,4-dien-1-yl)piperidin-2-ol
PubChem CID163423969
Molecular FormulaC12H19NO
Molecular Weight193.29 g/mol
Exact Mass193.15
IUPAC Name1-(4-methylcyclohexa-2,4-dien-1-yl)piperidin-2-ol
SMILESCC1=CCC(N2CCCCC2O)C=C1
InChIInChI=1S/C12H19NO/c1-10-5-7-11(8-6-10)13-9-3-2-4-12(13)14/h5-7,11-12,14H,2-4,8-9H2,1H3
InChIKeyAKWQDWXCVVIGJA-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

Analyze 1-(4-methylcyclohexa-2,4-dien-1-yl)piperidin-2-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-hydroxy-N-methyl-tetrahydroisoquinoline
CID 129678249
1-[(3Z,5E)-5-fluorohepta-3,5-dienyl]piperidin-2-ol
CID 144373272
(2S,5E)-5-[(9aR)-1-methyl-4,6,7,8,9,9a-hexahydroquinolizin-3-ylidene]pentan-2-ol
CID 15939795
5-(1-Methyl-4,6,7,8,9,9a-hexahydroquinolizin-3-ylidene)pentan-2-ol
CID 73201034
(Z)-5-((S)-9-Methyl-3,4-dihydro-1H-quinolizin-7(2H,6H,9aH)-ylidene)pentan-2-ol
CID 91735640
(5E)-5-[(9aS)-1-methyl-4,6,7,8,9,9a-hexahydroquinolizin-3-ylidene]pentan-2-ol
CID 101385673
[1-(1-Ethylcyclohexa-2,4-dien-1-yl)piperidin-2-yl]methanol
CID 70044331
1-(Cyclohexa-1,5-dien-1-ylmethyl)-2-ethylpiperidin-4-ol
CID 87674939
2-[1-(2-Methylidenepent-3-enyl)piperidin-2-yl]ethanol
CID 123461604
5,6-Di(ethylidene)-1-methylpiperidin-2-ol
CID 123615765
2-[5-(1-Methylpiperidin-1-ium-1-yl)cyclohex-3-en-1-yl]ethanol
CID 123856754
2-methyl-3,4,4a,5-tetrahydro-1H-isoquinolin-1-ol
CID 141374768

Frequently Asked Questions

What is the IUPAC name of 1-(4-methylcyclohexa-2,4-dien-1-yl)piperidin-2-ol?
The IUPAC name of 1-(4-methylcyclohexa-2,4-dien-1-yl)piperidin-2-ol (CID 163423969) is 1-(4-methylcyclohexa-2,4-dien-1-yl)piperidin-2-ol.
What is the SMILES notation for 1-(4-methylcyclohexa-2,4-dien-1-yl)piperidin-2-ol?
The canonical SMILES for 1-(4-methylcyclohexa-2,4-dien-1-yl)piperidin-2-ol is CC1=CCC(N2CCCCC2O)C=C1.
What is the InChIKey of 1-(4-methylcyclohexa-2,4-dien-1-yl)piperidin-2-ol?
The InChIKey is AKWQDWXCVVIGJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO/c1-10-5-7-11(8-6-10)13-9-3-2-4-12(13)14/h5-7,11-12,14H,2-4,8-9H2,1H3.
What are the key properties of 1-(4-methylcyclohexa-2,4-dien-1-yl)piperidin-2-ol?
1-(4-methylcyclohexa-2,4-dien-1-yl)piperidin-2-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-(4-methylcyclohexa-2,4-dien-1-yl)piperidin-2-ol is sourced from PubChem (CID 163423969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).