4-(1-hydroxy-3,5-dimethylcyclohexa-2,4-dien-1-yl)-2,6-dimethylphenol

C16H20O2 — CID 151016478

IUPAC4-(1-hydroxy-3,5-dimethylcyclohexa-2,4-dien-1-yl)-2,6-dimethylphenol
SMILESCC1=CC(O)(c2cc(C)c(O)c(C)c2)CC(C)=C1
InChIInChI=1S/C16H20O2/c1-10-5-11(2)9-16(18,8-10)14-6-12(3)15(17)13(4)7-14/h5-8,17-18H,9H2,1-4H3
InChIKeyLXEGKODOPPUVGI-UHFFFAOYSA-N
MW244.33 g/mol
LogP3.49
Rot. Bonds1

About 4-(1-hydroxy-3,5-dimethylcyclohexa-2,4-dien-1-yl)-2,6-dimethylphenol

4-(1-hydroxy-3,5-dimethylcyclohexa-2,4-dien-1-yl)-2,6-dimethylphenol (PubChem CID 151016478) has the molecular formula C16H20O2 and a molecular weight of 244.33 g/mol. Its IUPAC name is 4-(1-hydroxy-3,5-dimethylcyclohexa-2,4-dien-1-yl)-2,6-dimethylphenol.

Molecular Properties

Compound Name4-(1-hydroxy-3,5-dimethylcyclohexa-2,4-dien-1-yl)-2,6-dimethylphenol
PubChem CID151016478
Molecular FormulaC16H20O2
Molecular Weight244.33 g/mol
Exact Mass244.15
IUPAC Name4-(1-hydroxy-3,5-dimethylcyclohexa-2,4-dien-1-yl)-2,6-dimethylphenol
SMILESCC1=CC(O)(c2cc(C)c(O)c(C)c2)CC(C)=C1
InChIInChI=1S/C16H20O2/c1-10-5-11(2)9-16(18,8-10)14-6-12(3)15(17)13(4)7-14/h5-8,17-18H,9H2,1-4H3
InChIKeyLXEGKODOPPUVGI-UHFFFAOYSA-N
XLogP3.49
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.33
LogP ≤ 53.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 4-(1-hydroxy-3,5-dimethylcyclohexa-2,4-dien-1-yl)-2,6-dimethylphenol with MolForge

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Related Compounds

1,3,5-trimethyl-2-(1,3,5-trimethylcyclohexa-2,4-dien-1-yl)benzene
CID 141041477
4-[1-(4-hydroxy-3,5-dimethylphenyl)cyclotetradecyl]-2,6-dimethylphenol
CID 154629594
1,3,5,5-tetramethylcyclohexa-1,3-diene;1,3,5-trimethylbenzene
CID 157288182
3-(4-hydroxy-3,5-dimethylphenyl)-1,1,3,6-tetramethyl-2H-inden-5-ol
CID 139669315
2-iodo-6-methyl-4-[1,4,4-tris(4-hydroxy-3,5-diiodophenyl)cyclohexyl]phenol
CID 142305595
1,3,5-trimethylcyclohexa-2,4-diene-1-carbaldehyde
CID 22625121
2,6-dimethyl-4-(4-phenylphenyl)phenol
CID 22900078
4-[4-[[4,4-bis(4-hydroxy-3,5-dimethylphenyl)cyclohexyl]methyl]-1-(4-hydroxy-3,5-dimethylphenyl)cyclohexyl]-2,6-dimethylphenol
CID 139895212
4-[1-(4-hydroxy-3,5-dimethylphenyl)-4-propan-2-ylcyclohexyl]-2,6-dimethylphenol
CID 22601829
4-[1-(4-hydroxy-3,5-dimethylphenyl)-2,4,4-trimethylcyclopentyl]-2,6-dimethylphenol
CID 18968520
5-(4-hydroxy-3,5-dimethylphenyl)-3-methylbenzene-1,2-diol
CID 130228173
4-(6-ethyl-2,4,4,6,8-pentamethyl-3,5-dihydrochromen-2-yl)-2,6-dimethylphenol
CID 18691662

Frequently Asked Questions

What is the IUPAC name of 4-(1-hydroxy-3,5-dimethylcyclohexa-2,4-dien-1-yl)-2,6-dimethylphenol?
The IUPAC name of 4-(1-hydroxy-3,5-dimethylcyclohexa-2,4-dien-1-yl)-2,6-dimethylphenol (CID 151016478) is 4-(1-hydroxy-3,5-dimethylcyclohexa-2,4-dien-1-yl)-2,6-dimethylphenol.
What is the SMILES notation for 4-(1-hydroxy-3,5-dimethylcyclohexa-2,4-dien-1-yl)-2,6-dimethylphenol?
The canonical SMILES for 4-(1-hydroxy-3,5-dimethylcyclohexa-2,4-dien-1-yl)-2,6-dimethylphenol is CC1=CC(O)(c2cc(C)c(O)c(C)c2)CC(C)=C1.
What is the InChIKey of 4-(1-hydroxy-3,5-dimethylcyclohexa-2,4-dien-1-yl)-2,6-dimethylphenol?
The InChIKey is LXEGKODOPPUVGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20O2/c1-10-5-11(2)9-16(18,8-10)14-6-12(3)15(17)13(4)7-14/h5-8,17-18H,9H2,1-4H3.
What are the key properties of 4-(1-hydroxy-3,5-dimethylcyclohexa-2,4-dien-1-yl)-2,6-dimethylphenol?
4-(1-hydroxy-3,5-dimethylcyclohexa-2,4-dien-1-yl)-2,6-dimethylphenol has a molecular weight of 244.33 g/mol, XLogP of 3.49, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-hydroxy-3,5-dimethylcyclohexa-2,4-dien-1-yl)-2,6-dimethylphenol is sourced from PubChem (CID 151016478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).