[1-[(2-methylphenyl)methyl]-3,4-dihydro-2H-naphthalen-1-yl]methanol

C19H22O — CID 66058133

IUPAC[1-[(2-methylphenyl)methyl]-3,4-dihydro-2H-naphthalen-1-yl]methanol
SMILESCc1ccccc1CC1(CO)CCCc2ccccc21
InChIInChI=1S/C19H22O/c1-15-7-2-3-9-17(15)13-19(14-20)12-6-10-16-8-4-5-11-18(16)19/h2-5,7-9,11,20H,6,10,12-14H2,1H3
InChIKeyJOSSTTGHXWGYLK-UHFFFAOYSA-N
MW266.38 g/mol
LogP3.80
Rot. Bonds3

About [1-[(2-methylphenyl)methyl]-3,4-dihydro-2H-naphthalen-1-yl]methanol

[1-[(2-methylphenyl)methyl]-3,4-dihydro-2H-naphthalen-1-yl]methanol (PubChem CID 66058133) has the molecular formula C19H22O and a molecular weight of 266.38 g/mol. Its IUPAC name is [1-[(2-methylphenyl)methyl]-3,4-dihydro-2H-naphthalen-1-yl]methanol.

Molecular Properties

Compound Name[1-[(2-methylphenyl)methyl]-3,4-dihydro-2H-naphthalen-1-yl]methanol
PubChem CID66058133
Molecular FormulaC19H22O
Molecular Weight266.38 g/mol
Exact Mass266.17
IUPAC Name[1-[(2-methylphenyl)methyl]-3,4-dihydro-2H-naphthalen-1-yl]methanol
SMILESCc1ccccc1CC1(CO)CCCc2ccccc21
InChIInChI=1S/C19H22O/c1-15-7-2-3-9-17(15)13-19(14-20)12-6-10-16-8-4-5-11-18(16)19/h2-5,7-9,11,20H,6,10,12-14H2,1H3
InChIKeyJOSSTTGHXWGYLK-UHFFFAOYSA-N
XLogP3.80
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of [1-[(2-methylphenyl)methyl]-3,4-dihydro-2H-naphthalen-1-yl]methanol?
The IUPAC name of [1-[(2-methylphenyl)methyl]-3,4-dihydro-2H-naphthalen-1-yl]methanol (CID 66058133) is [1-[(2-methylphenyl)methyl]-3,4-dihydro-2H-naphthalen-1-yl]methanol.
What is the SMILES notation for [1-[(2-methylphenyl)methyl]-3,4-dihydro-2H-naphthalen-1-yl]methanol?
The canonical SMILES for [1-[(2-methylphenyl)methyl]-3,4-dihydro-2H-naphthalen-1-yl]methanol is Cc1ccccc1CC1(CO)CCCc2ccccc21.
What is the InChIKey of [1-[(2-methylphenyl)methyl]-3,4-dihydro-2H-naphthalen-1-yl]methanol?
The InChIKey is JOSSTTGHXWGYLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22O/c1-15-7-2-3-9-17(15)13-19(14-20)12-6-10-16-8-4-5-11-18(16)19/h2-5,7-9,11,20H,6,10,12-14H2,1H3.
What are the key properties of [1-[(2-methylphenyl)methyl]-3,4-dihydro-2H-naphthalen-1-yl]methanol?
[1-[(2-methylphenyl)methyl]-3,4-dihydro-2H-naphthalen-1-yl]methanol has a molecular weight of 266.38 g/mol, XLogP of 3.80, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(2-methylphenyl)methyl]-3,4-dihydro-2H-naphthalen-1-yl]methanol is sourced from PubChem (CID 66058133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).