2-(2,3-dimethylphenyl)-3,4-dihydro-1H-naphthalen-2-ol

C18H20O — CID 62549374

IUPAC2-(2,3-dimethylphenyl)-3,4-dihydro-1H-naphthalen-2-ol
SMILESCc1cccc(C2(O)CCc3ccccc3C2)c1C
InChIInChI=1S/C18H20O/c1-13-6-5-9-17(14(13)2)18(19)11-10-15-7-3-4-8-16(15)12-18/h3-9,19H,10-12H2,1-2H3
InChIKeyGVXCIBQXBMWLJF-UHFFFAOYSA-N
MW252.36 g/mol
LogP3.68
Rot. Bonds1

About 2-(2,3-dimethylphenyl)-3,4-dihydro-1H-naphthalen-2-ol

2-(2,3-dimethylphenyl)-3,4-dihydro-1H-naphthalen-2-ol (PubChem CID 62549374) has the molecular formula C18H20O and a molecular weight of 252.36 g/mol. Its IUPAC name is 2-(2,3-dimethylphenyl)-3,4-dihydro-1H-naphthalen-2-ol.

Molecular Properties

Compound Name2-(2,3-dimethylphenyl)-3,4-dihydro-1H-naphthalen-2-ol
PubChem CID62549374
Molecular FormulaC18H20O
Molecular Weight252.36 g/mol
Exact Mass252.15
IUPAC Name2-(2,3-dimethylphenyl)-3,4-dihydro-1H-naphthalen-2-ol
SMILESCc1cccc(C2(O)CCc3ccccc3C2)c1C
InChIInChI=1S/C18H20O/c1-13-6-5-9-17(14(13)2)18(19)11-10-15-7-3-4-8-16(15)12-18/h3-9,19H,10-12H2,1-2H3
InChIKeyGVXCIBQXBMWLJF-UHFFFAOYSA-N
XLogP3.68
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dimethylphenyl)-3,4-dihydro-1H-naphthalen-2-ol?
The IUPAC name of 2-(2,3-dimethylphenyl)-3,4-dihydro-1H-naphthalen-2-ol (CID 62549374) is 2-(2,3-dimethylphenyl)-3,4-dihydro-1H-naphthalen-2-ol.
What is the SMILES notation for 2-(2,3-dimethylphenyl)-3,4-dihydro-1H-naphthalen-2-ol?
The canonical SMILES for 2-(2,3-dimethylphenyl)-3,4-dihydro-1H-naphthalen-2-ol is Cc1cccc(C2(O)CCc3ccccc3C2)c1C.
What is the InChIKey of 2-(2,3-dimethylphenyl)-3,4-dihydro-1H-naphthalen-2-ol?
The InChIKey is GVXCIBQXBMWLJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20O/c1-13-6-5-9-17(14(13)2)18(19)11-10-15-7-3-4-8-16(15)12-18/h3-9,19H,10-12H2,1-2H3.
What are the key properties of 2-(2,3-dimethylphenyl)-3,4-dihydro-1H-naphthalen-2-ol?
2-(2,3-dimethylphenyl)-3,4-dihydro-1H-naphthalen-2-ol has a molecular weight of 252.36 g/mol, XLogP of 3.68, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dimethylphenyl)-3,4-dihydro-1H-naphthalen-2-ol is sourced from PubChem (CID 62549374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).