3-(2,3-dihydro-1H-inden-5-yl)-5,5-dimethylcyclohex-2-en-1-ol

C17H22O — CID 114194594

IUPAC3-(2,3-dihydro-1H-inden-5-yl)-5,5-dimethylcyclohex-2-en-1-ol
SMILESCC1(C)CC(c2ccc3c(c2)CCC3)=CC(O)C1
InChIInChI=1S/C17H22O/c1-17(2)10-15(9-16(18)11-17)14-7-6-12-4-3-5-13(12)8-14/h6-9,16,18H,3-5,10-11H2,1-2H3
InChIKeyBWVCBPYZAPHQCO-UHFFFAOYSA-N
MW242.36 g/mol
LogP3.74
Rot. Bonds1

About 3-(2,3-dihydro-1H-inden-5-yl)-5,5-dimethylcyclohex-2-en-1-ol

3-(2,3-dihydro-1H-inden-5-yl)-5,5-dimethylcyclohex-2-en-1-ol (PubChem CID 114194594) has the molecular formula C17H22O and a molecular weight of 242.36 g/mol. Its IUPAC name is 3-(2,3-dihydro-1H-inden-5-yl)-5,5-dimethylcyclohex-2-en-1-ol.

Molecular Properties

Compound Name3-(2,3-dihydro-1H-inden-5-yl)-5,5-dimethylcyclohex-2-en-1-ol
PubChem CID114194594
Molecular FormulaC17H22O
Molecular Weight242.36 g/mol
Exact Mass242.17
IUPAC Name3-(2,3-dihydro-1H-inden-5-yl)-5,5-dimethylcyclohex-2-en-1-ol
SMILESCC1(C)CC(c2ccc3c(c2)CCC3)=CC(O)C1
InChIInChI=1S/C17H22O/c1-17(2)10-15(9-16(18)11-17)14-7-6-12-4-3-5-13(12)8-14/h6-9,16,18H,3-5,10-11H2,1-2H3
InChIKeyBWVCBPYZAPHQCO-UHFFFAOYSA-N
XLogP3.74
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

5,5-dimethyl-3-(3-methylphenyl)cyclohex-2-en-1-ol
CID 65177369
5-(4-methylphenyl)-2,3-dihydro-1H-indene
CID 59217485
3-(2,4-dimethylphenyl)-5,5-dimethylcyclohex-2-en-1-ol
CID 65176982
5-(4-fluorophenyl)-2,3-dihydro-1H-indene
CID 141092237
5-(cyclohexen-1-yl)-2,3-dihydro-1H-indene
CID 123334051
5-(4-methoxyphenyl)-2,3-dihydro-1H-indene
CID 174495495
2,3-dihydro-1H-inden-5-yl-(2,2,3,3-tetramethylcyclopropyl)methanol
CID 66476377
7,7-dimethyl-2,3,5,6,8,9-hexahydro-1H-cyclohepta[f]inden-5-ol
CID 113319284
4-(2,3-dihydro-1H-inden-5-yl)-2-methylaniline
CID 54912598
4-(2,3-dihydro-1H-inden-5-yl)-2-methylphenol
CID 166178430
9,9-dimethyl-2,7-bis(5,6,7,8-tetrahydronaphthalen-2-yl)fluorene
CID 59217252
5,5-dimethyl-3-(3-methyltriazol-4-yl)cyclohex-2-en-1-ol
CID 114690562

Frequently Asked Questions

What is the IUPAC name of 3-(2,3-dihydro-1H-inden-5-yl)-5,5-dimethylcyclohex-2-en-1-ol?
The IUPAC name of 3-(2,3-dihydro-1H-inden-5-yl)-5,5-dimethylcyclohex-2-en-1-ol (CID 114194594) is 3-(2,3-dihydro-1H-inden-5-yl)-5,5-dimethylcyclohex-2-en-1-ol.
What is the SMILES notation for 3-(2,3-dihydro-1H-inden-5-yl)-5,5-dimethylcyclohex-2-en-1-ol?
The canonical SMILES for 3-(2,3-dihydro-1H-inden-5-yl)-5,5-dimethylcyclohex-2-en-1-ol is CC1(C)CC(c2ccc3c(c2)CCC3)=CC(O)C1.
What is the InChIKey of 3-(2,3-dihydro-1H-inden-5-yl)-5,5-dimethylcyclohex-2-en-1-ol?
The InChIKey is BWVCBPYZAPHQCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22O/c1-17(2)10-15(9-16(18)11-17)14-7-6-12-4-3-5-13(12)8-14/h6-9,16,18H,3-5,10-11H2,1-2H3.
What are the key properties of 3-(2,3-dihydro-1H-inden-5-yl)-5,5-dimethylcyclohex-2-en-1-ol?
3-(2,3-dihydro-1H-inden-5-yl)-5,5-dimethylcyclohex-2-en-1-ol has a molecular weight of 242.36 g/mol, XLogP of 3.74, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,3-dihydro-1H-inden-5-yl)-5,5-dimethylcyclohex-2-en-1-ol is sourced from PubChem (CID 114194594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).