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

C19H22O2 — CID 103432445

IUPAC2-(2-methoxy-3,4-dimethylphenyl)-3,4-dihydro-1H-naphthalen-2-ol
SMILESCOc1c(C2(O)CCc3ccccc3C2)ccc(C)c1C
InChIInChI=1S/C19H22O2/c1-13-8-9-17(18(21-3)14(13)2)19(20)11-10-15-6-4-5-7-16(15)12-19/h4-9,20H,10-12H2,1-3H3
InChIKeyGEAYSEHKAMDYKZ-UHFFFAOYSA-N
MW282.38 g/mol
LogP3.69
Rot. Bonds2

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

2-(2-methoxy-3,4-dimethylphenyl)-3,4-dihydro-1H-naphthalen-2-ol (PubChem CID 103432445) has the molecular formula C19H22O2 and a molecular weight of 282.38 g/mol. Its IUPAC name is 2-(2-methoxy-3,4-dimethylphenyl)-3,4-dihydro-1H-naphthalen-2-ol.

Molecular Properties

Compound Name2-(2-methoxy-3,4-dimethylphenyl)-3,4-dihydro-1H-naphthalen-2-ol
PubChem CID103432445
Molecular FormulaC19H22O2
Molecular Weight282.38 g/mol
Exact Mass282.16
IUPAC Name2-(2-methoxy-3,4-dimethylphenyl)-3,4-dihydro-1H-naphthalen-2-ol
SMILESCOc1c(C2(O)CCc3ccccc3C2)ccc(C)c1C
InChIInChI=1S/C19H22O2/c1-13-8-9-17(18(21-3)14(13)2)19(20)11-10-15-6-4-5-7-16(15)12-19/h4-9,20H,10-12H2,1-3H3
InChIKeyGEAYSEHKAMDYKZ-UHFFFAOYSA-N
XLogP3.69
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.38
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxy-3,4-dimethylphenyl)-3,4-dihydro-1H-naphthalen-2-ol?
The IUPAC name of 2-(2-methoxy-3,4-dimethylphenyl)-3,4-dihydro-1H-naphthalen-2-ol (CID 103432445) is 2-(2-methoxy-3,4-dimethylphenyl)-3,4-dihydro-1H-naphthalen-2-ol.
What is the SMILES notation for 2-(2-methoxy-3,4-dimethylphenyl)-3,4-dihydro-1H-naphthalen-2-ol?
The canonical SMILES for 2-(2-methoxy-3,4-dimethylphenyl)-3,4-dihydro-1H-naphthalen-2-ol is COc1c(C2(O)CCc3ccccc3C2)ccc(C)c1C.
What is the InChIKey of 2-(2-methoxy-3,4-dimethylphenyl)-3,4-dihydro-1H-naphthalen-2-ol?
The InChIKey is GEAYSEHKAMDYKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22O2/c1-13-8-9-17(18(21-3)14(13)2)19(20)11-10-15-6-4-5-7-16(15)12-19/h4-9,20H,10-12H2,1-3H3.
What are the key properties of 2-(2-methoxy-3,4-dimethylphenyl)-3,4-dihydro-1H-naphthalen-2-ol?
2-(2-methoxy-3,4-dimethylphenyl)-3,4-dihydro-1H-naphthalen-2-ol has a molecular weight of 282.38 g/mol, XLogP of 3.69, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxy-3,4-dimethylphenyl)-3,4-dihydro-1H-naphthalen-2-ol is sourced from PubChem (CID 103432445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).