2-[(2-methylphenyl)methyl]-1,3-dihydroinden-2-ol

C17H18O — CID 60797949

IUPAC2-[(2-methylphenyl)methyl]-1,3-dihydroinden-2-ol
SMILESCc1ccccc1CC1(O)Cc2ccccc2C1
InChIInChI=1S/C17H18O/c1-13-6-2-3-7-14(13)10-17(18)11-15-8-4-5-9-16(15)12-17/h2-9,18H,10-12H2,1H3
InChIKeyQUPAORXXZLTYEU-UHFFFAOYSA-N
MW238.33 g/mol
LogP3.07
Rot. Bonds2

About 2-[(2-methylphenyl)methyl]-1,3-dihydroinden-2-ol

2-[(2-methylphenyl)methyl]-1,3-dihydroinden-2-ol (PubChem CID 60797949) has the molecular formula C17H18O and a molecular weight of 238.33 g/mol. Its IUPAC name is 2-[(2-methylphenyl)methyl]-1,3-dihydroinden-2-ol.

Molecular Properties

Compound Name2-[(2-methylphenyl)methyl]-1,3-dihydroinden-2-ol
PubChem CID60797949
Molecular FormulaC17H18O
Molecular Weight238.33 g/mol
Exact Mass238.14
IUPAC Name2-[(2-methylphenyl)methyl]-1,3-dihydroinden-2-ol
SMILESCc1ccccc1CC1(O)Cc2ccccc2C1
InChIInChI=1S/C17H18O/c1-13-6-2-3-7-14(13)10-17(18)11-15-8-4-5-9-16(15)12-17/h2-9,18H,10-12H2,1H3
InChIKeyQUPAORXXZLTYEU-UHFFFAOYSA-N
XLogP3.07
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 ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-[(2-methylphenyl)methyl]-3,4-dihydro-1H-naphthalene-2-carbonitrile
CID 65408631
[1-[(2-methylphenyl)methyl]-3,4-dihydro-2H-naphthalen-1-yl]methanol
CID 66058133
2-[(2-chloro-4-fluorophenyl)methyl]-1,3-dihydroinden-2-ol
CID 65147155
2-[(2-chloro-4-methylphenyl)methyl]-3,4-dihydro-1H-naphthalen-2-ol
CID 106866083
1-[(2-methylphenyl)methyl]-4-propylcycloheptan-1-ol
CID 65090602
4-[4-hydroxy-4-[(2-methylphenyl)methyl]piperidin-1-yl]benzonitrile
CID 59186682
2-[(3-methoxyphenyl)methyl]-1,3-dihydroinden-2-ol
CID 65147763
1-(5,6,7,8-tetrahydronaphthalen-1-ylmethyl)cyclopropan-1-ol
CID 117291079
2-[(3-chlorophenyl)methyl]-1,3-dihydroinden-2-ol
CID 60799487
[1-[(2-methylphenyl)methyl]-2,3-dihydroinden-1-yl]methanamine
CID 65409246
1-[(2,2-dimethyl-3H-1-benzofuran-7-yl)methyl]cyclopropan-1-ol
CID 117311226
2-(2-aminoethyl)-1,3-dihydroinden-2-ol;hydrochloride
CID 139026716

Frequently Asked Questions

What is the IUPAC name of 2-[(2-methylphenyl)methyl]-1,3-dihydroinden-2-ol?
The IUPAC name of 2-[(2-methylphenyl)methyl]-1,3-dihydroinden-2-ol (CID 60797949) is 2-[(2-methylphenyl)methyl]-1,3-dihydroinden-2-ol.
What is the SMILES notation for 2-[(2-methylphenyl)methyl]-1,3-dihydroinden-2-ol?
The canonical SMILES for 2-[(2-methylphenyl)methyl]-1,3-dihydroinden-2-ol is Cc1ccccc1CC1(O)Cc2ccccc2C1.
What is the InChIKey of 2-[(2-methylphenyl)methyl]-1,3-dihydroinden-2-ol?
The InChIKey is QUPAORXXZLTYEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18O/c1-13-6-2-3-7-14(13)10-17(18)11-15-8-4-5-9-16(15)12-17/h2-9,18H,10-12H2,1H3.
What are the key properties of 2-[(2-methylphenyl)methyl]-1,3-dihydroinden-2-ol?
2-[(2-methylphenyl)methyl]-1,3-dihydroinden-2-ol has a molecular weight of 238.33 g/mol, XLogP of 3.07, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-methylphenyl)methyl]-1,3-dihydroinden-2-ol is sourced from PubChem (CID 60797949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).