2,6-dimethyl-2-(4-methylphenyl)-3,4-dihydro-1H-naphthalen-1-ol

C19H22O — CID 23537896

IUPAC2,6-dimethyl-2-(4-methylphenyl)-3,4-dihydro-1H-naphthalen-1-ol
SMILESCc1ccc(C2(C)CCc3cc(C)ccc3C2O)cc1
InChIInChI=1S/C19H22O/c1-13-4-7-16(8-5-13)19(3)11-10-15-12-14(2)6-9-17(15)18(19)20/h4-9,12,18,20H,10-11H2,1-3H3
InChIKeyPSNKLTWZDOAJGP-UHFFFAOYSA-N
MW266.38 g/mol
LogP4.24
Rot. Bonds1

About 2,6-dimethyl-2-(4-methylphenyl)-3,4-dihydro-1H-naphthalen-1-ol

2,6-dimethyl-2-(4-methylphenyl)-3,4-dihydro-1H-naphthalen-1-ol (PubChem CID 23537896) has the molecular formula C19H22O and a molecular weight of 266.38 g/mol. Its IUPAC name is 2,6-dimethyl-2-(4-methylphenyl)-3,4-dihydro-1H-naphthalen-1-ol.

Molecular Properties

Compound Name2,6-dimethyl-2-(4-methylphenyl)-3,4-dihydro-1H-naphthalen-1-ol
PubChem CID23537896
Molecular FormulaC19H22O
Molecular Weight266.38 g/mol
Exact Mass266.17
IUPAC Name2,6-dimethyl-2-(4-methylphenyl)-3,4-dihydro-1H-naphthalen-1-ol
SMILESCc1ccc(C2(C)CCc3cc(C)ccc3C2O)cc1
InChIInChI=1S/C19H22O/c1-13-4-7-16(8-5-13)19(3)11-10-15-12-14(2)6-9-17(15)18(19)20/h4-9,12,18,20H,10-11H2,1-3H3
InChIKeyPSNKLTWZDOAJGP-UHFFFAOYSA-N
XLogP4.24
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-2-(4-methylphenyl)-3,4-dihydro-1H-naphthalen-1-ol?
The IUPAC name of 2,6-dimethyl-2-(4-methylphenyl)-3,4-dihydro-1H-naphthalen-1-ol (CID 23537896) is 2,6-dimethyl-2-(4-methylphenyl)-3,4-dihydro-1H-naphthalen-1-ol.
What is the SMILES notation for 2,6-dimethyl-2-(4-methylphenyl)-3,4-dihydro-1H-naphthalen-1-ol?
The canonical SMILES for 2,6-dimethyl-2-(4-methylphenyl)-3,4-dihydro-1H-naphthalen-1-ol is Cc1ccc(C2(C)CCc3cc(C)ccc3C2O)cc1.
What is the InChIKey of 2,6-dimethyl-2-(4-methylphenyl)-3,4-dihydro-1H-naphthalen-1-ol?
The InChIKey is PSNKLTWZDOAJGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22O/c1-13-4-7-16(8-5-13)19(3)11-10-15-12-14(2)6-9-17(15)18(19)20/h4-9,12,18,20H,10-11H2,1-3H3.
What are the key properties of 2,6-dimethyl-2-(4-methylphenyl)-3,4-dihydro-1H-naphthalen-1-ol?
2,6-dimethyl-2-(4-methylphenyl)-3,4-dihydro-1H-naphthalen-1-ol has a molecular weight of 266.38 g/mol, XLogP of 4.24, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-2-(4-methylphenyl)-3,4-dihydro-1H-naphthalen-1-ol is sourced from PubChem (CID 23537896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).