4-(2,3-dihydro-1H-inden-5-yl)-2-methylphenol

C16H16O — CID 166178430

IUPAC4-(2,3-dihydro-1H-inden-5-yl)-2-methylphenol
SMILESCc1cc(-c2ccc3c(c2)CCC3)ccc1O
InChIInChI=1S/C16H16O/c1-11-9-14(7-8-16(11)17)15-6-5-12-3-2-4-13(12)10-15/h5-10,17H,2-4H2,1H3
InChIKeyGWVSJGRRUHIENY-UHFFFAOYSA-N
MW224.30 g/mol
LogP3.86
Rot. Bonds1

About 4-(2,3-dihydro-1H-inden-5-yl)-2-methylphenol

4-(2,3-dihydro-1H-inden-5-yl)-2-methylphenol (PubChem CID 166178430) has the molecular formula C16H16O and a molecular weight of 224.30 g/mol. Its IUPAC name is 4-(2,3-dihydro-1H-inden-5-yl)-2-methylphenol.

Molecular Properties

Compound Name4-(2,3-dihydro-1H-inden-5-yl)-2-methylphenol
PubChem CID166178430
Molecular FormulaC16H16O
Molecular Weight224.30 g/mol
Exact Mass224.12
IUPAC Name4-(2,3-dihydro-1H-inden-5-yl)-2-methylphenol
SMILESCc1cc(-c2ccc3c(c2)CCC3)ccc1O
InChIInChI=1S/C16H16O/c1-11-9-14(7-8-16(11)17)15-6-5-12-3-2-4-13(12)10-15/h5-10,17H,2-4H2,1H3
InChIKeyGWVSJGRRUHIENY-UHFFFAOYSA-N
XLogP3.86
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.30
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

5-(4-methylphenyl)-2,3-dihydro-1H-indene
CID 59217485
4-(2,3-dihydro-1H-inden-5-yl)-2-methylaniline
CID 54912598
4-[6-(4-hydroxy-3-methylphenyl)-1,2-dihydroacenaphthylen-5-yl]-2-methylphenol
CID 11793283
3-methyl-4-(5,6,7,8-tetrahydronaphthalen-2-yl)phenol
CID 167878538
2-methyl-4-(4-phenylphenyl)phenol
CID 83131251
5-(4-fluorophenyl)-2,3-dihydro-1H-indene
CID 141092237
5-(4-methoxyphenyl)-2,3-dihydro-1H-indene
CID 174495495
3-(2,3-dihydro-1H-inden-5-yl)-5-methylaniline
CID 107579783
5-(2,3-dimethylphenyl)-2,3-dihydro-1H-indene
CID 173291568
5-fluoro-2,3-dihydro-1H-indene;N-methylhydroxylamine;2-methylphenol
CID 143367569
5-(2-chloro-6-methylphenyl)-2,3-dihydro-1H-indene
CID 66253158
4-(4-hydroxy-2-methylphenyl)-3-methylphenol;4-(4-hydroxy-3-methylphenyl)-2-methylphenol
CID 71293385

Frequently Asked Questions

What is the IUPAC name of 4-(2,3-dihydro-1H-inden-5-yl)-2-methylphenol?
The IUPAC name of 4-(2,3-dihydro-1H-inden-5-yl)-2-methylphenol (CID 166178430) is 4-(2,3-dihydro-1H-inden-5-yl)-2-methylphenol.
What is the SMILES notation for 4-(2,3-dihydro-1H-inden-5-yl)-2-methylphenol?
The canonical SMILES for 4-(2,3-dihydro-1H-inden-5-yl)-2-methylphenol is Cc1cc(-c2ccc3c(c2)CCC3)ccc1O.
What is the InChIKey of 4-(2,3-dihydro-1H-inden-5-yl)-2-methylphenol?
The InChIKey is GWVSJGRRUHIENY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16O/c1-11-9-14(7-8-16(11)17)15-6-5-12-3-2-4-13(12)10-15/h5-10,17H,2-4H2,1H3.
What are the key properties of 4-(2,3-dihydro-1H-inden-5-yl)-2-methylphenol?
4-(2,3-dihydro-1H-inden-5-yl)-2-methylphenol has a molecular weight of 224.30 g/mol, XLogP of 3.86, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,3-dihydro-1H-inden-5-yl)-2-methylphenol is sourced from PubChem (CID 166178430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).