2,3-dihydro-1H-inden-1-yl-(2-methylphenyl)methanol

C17H18O — CID 65410784

IUPAC2,3-dihydro-1H-inden-1-yl-(2-methylphenyl)methanol
SMILESCc1ccccc1C(O)C1CCc2ccccc21
InChIInChI=1S/C17H18O/c1-12-6-2-4-8-14(12)17(18)16-11-10-13-7-3-5-9-15(13)16/h2-9,16-18H,10-11H2,1H3
InChIKeyYMNHHZANTYRJJJ-UHFFFAOYSA-N
MW238.33 g/mol
LogP3.76
Rot. Bonds2

About 2,3-dihydro-1H-inden-1-yl-(2-methylphenyl)methanol

2,3-dihydro-1H-inden-1-yl-(2-methylphenyl)methanol (PubChem CID 65410784) has the molecular formula C17H18O and a molecular weight of 238.33 g/mol. Its IUPAC name is 2,3-dihydro-1H-inden-1-yl-(2-methylphenyl)methanol.

Molecular Properties

Compound Name2,3-dihydro-1H-inden-1-yl-(2-methylphenyl)methanol
PubChem CID65410784
Molecular FormulaC17H18O
Molecular Weight238.33 g/mol
Exact Mass238.14
IUPAC Name2,3-dihydro-1H-inden-1-yl-(2-methylphenyl)methanol
SMILESCc1ccccc1C(O)C1CCc2ccccc21
InChIInChI=1S/C17H18O/c1-12-6-2-4-8-14(12)17(18)16-11-10-13-7-3-5-9-15(13)16/h2-9,16-18H,10-11H2,1H3
InChIKeyYMNHHZANTYRJJJ-UHFFFAOYSA-N
XLogP3.76
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-1H-inden-1-yl-(2-methylphenyl)methanol?
The IUPAC name of 2,3-dihydro-1H-inden-1-yl-(2-methylphenyl)methanol (CID 65410784) is 2,3-dihydro-1H-inden-1-yl-(2-methylphenyl)methanol.
What is the SMILES notation for 2,3-dihydro-1H-inden-1-yl-(2-methylphenyl)methanol?
The canonical SMILES for 2,3-dihydro-1H-inden-1-yl-(2-methylphenyl)methanol is Cc1ccccc1C(O)C1CCc2ccccc21.
What is the InChIKey of 2,3-dihydro-1H-inden-1-yl-(2-methylphenyl)methanol?
The InChIKey is YMNHHZANTYRJJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18O/c1-12-6-2-4-8-14(12)17(18)16-11-10-13-7-3-5-9-15(13)16/h2-9,16-18H,10-11H2,1H3.
What are the key properties of 2,3-dihydro-1H-inden-1-yl-(2-methylphenyl)methanol?
2,3-dihydro-1H-inden-1-yl-(2-methylphenyl)methanol has a molecular weight of 238.33 g/mol, XLogP of 3.76, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydro-1H-inden-1-yl-(2-methylphenyl)methanol is sourced from PubChem (CID 65410784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).