5-methyl-2-propan-2-ylcyclohexa-1,5-dien-1-ol

C10H16O — CID 53249447

IUPAC5-methyl-2-propan-2-ylcyclohexa-1,5-dien-1-ol
SMILESCC1=CC(O)=C(C(C)C)CC1
InChIInChI=1S/C10H16O/c1-7(2)9-5-4-8(3)6-10(9)11/h6-7,11H,4-5H2,1-3H3
InChIKeyIOJPUZYGYNQZBZ-UHFFFAOYSA-N
MW152.24 g/mol
LogP3.19
Rot. Bonds1

About 5-methyl-2-propan-2-ylcyclohexa-1,5-dien-1-ol

5-methyl-2-propan-2-ylcyclohexa-1,5-dien-1-ol (PubChem CID 53249447) has the molecular formula C10H16O and a molecular weight of 152.24 g/mol. Its IUPAC name is 5-methyl-2-propan-2-ylcyclohexa-1,5-dien-1-ol.

Molecular Properties

Compound Name5-methyl-2-propan-2-ylcyclohexa-1,5-dien-1-ol
PubChem CID53249447
Molecular FormulaC10H16O
Molecular Weight152.24 g/mol
Exact Mass152.12
IUPAC Name5-methyl-2-propan-2-ylcyclohexa-1,5-dien-1-ol
SMILESCC1=CC(O)=C(C(C)C)CC1
InChIInChI=1S/C10H16O/c1-7(2)9-5-4-8(3)6-10(9)11/h6-7,11H,4-5H2,1-3H3
InChIKeyIOJPUZYGYNQZBZ-UHFFFAOYSA-N
XLogP3.19
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 5-methyl-2-propan-2-ylcyclohexa-1,5-dien-1-ol with MolForge

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Related Compounds

2-Methyl-5-propan-2-ylcyclohexa-1,5-dien-1-ol
CID 13670329
(3E,5E)-6-cyclohexyl-2-methylhepta-3,5-dien-2-ol
CID 118715380
(3E,5E)-2-methyl-6-(4-methylcyclohex-3-en-1-yl)hepta-3,5-dien-2-ol
CID 118715382
3,8-Dimethyl-5-propan-2-yl-4,4a,5,6-tetrahydronaphthalen-2-ol
CID 163186211
p-Mentha-1,3-dien-8-ol
CID 6428796
2,4-Di-t-butyl-4-methylphenol
CID 66643304
(3Z)-3,4-difluoro-6,9-dimethyl-5-methylidenedeca-1,3-dien-2-ol
CID 143777055
(3E,7Z)-3-fluoro-10,13-dimethyl-5,6,9-trimethylidenetetradeca-1,3,7-trien-2-ol
CID 144055817
(4S)-6-fluoro-5-methyl-4-(4-methylcyclohexen-1-yl)cyclohexa-1,5-dien-1-ol
CID 163479826
(4E)-4-(1-fluorobutan-2-ylidene)-3,5-dimethylcyclohexa-1,5-dien-1-ol
CID 167120362
6-Fluoro-2,5-di(propan-2-yl)cyclohexa-1,5-dien-1-ol
CID 172585968
6-Fluoro-5-methyl-2-propan-2-ylcyclohexa-1,5-dien-1-ol
CID 172586012

Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-propan-2-ylcyclohexa-1,5-dien-1-ol?
The IUPAC name of 5-methyl-2-propan-2-ylcyclohexa-1,5-dien-1-ol (CID 53249447) is 5-methyl-2-propan-2-ylcyclohexa-1,5-dien-1-ol.
What is the SMILES notation for 5-methyl-2-propan-2-ylcyclohexa-1,5-dien-1-ol?
The canonical SMILES for 5-methyl-2-propan-2-ylcyclohexa-1,5-dien-1-ol is CC1=CC(O)=C(C(C)C)CC1.
What is the InChIKey of 5-methyl-2-propan-2-ylcyclohexa-1,5-dien-1-ol?
The InChIKey is IOJPUZYGYNQZBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16O/c1-7(2)9-5-4-8(3)6-10(9)11/h6-7,11H,4-5H2,1-3H3.
What are the key properties of 5-methyl-2-propan-2-ylcyclohexa-1,5-dien-1-ol?
5-methyl-2-propan-2-ylcyclohexa-1,5-dien-1-ol has a molecular weight of 152.24 g/mol, XLogP of 3.19, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-propan-2-ylcyclohexa-1,5-dien-1-ol is sourced from PubChem (CID 53249447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).