2-(4-fluorophenoxy)-6-methoxy-2,3-dihydro-1H-inden-1-ol

C16H15FO3 — CID 79374018

IUPAC2-(4-fluorophenoxy)-6-methoxy-2,3-dihydro-1H-inden-1-ol
SMILESCOc1ccc2c(c1)C(O)C(Oc1ccc(F)cc1)C2
InChIInChI=1S/C16H15FO3/c1-19-13-5-2-10-8-15(16(18)14(10)9-13)20-12-6-3-11(17)4-7-12/h2-7,9,15-16,18H,8H2,1H3
InChIKeyHEVTWSMMYATOKP-UHFFFAOYSA-N
MW274.29 g/mol
LogP2.87
Rot. Bonds3

About 2-(4-fluorophenoxy)-6-methoxy-2,3-dihydro-1H-inden-1-ol

2-(4-fluorophenoxy)-6-methoxy-2,3-dihydro-1H-inden-1-ol (PubChem CID 79374018) has the molecular formula C16H15FO3 and a molecular weight of 274.29 g/mol. Its IUPAC name is 2-(4-fluorophenoxy)-6-methoxy-2,3-dihydro-1H-inden-1-ol.

Molecular Properties

Compound Name2-(4-fluorophenoxy)-6-methoxy-2,3-dihydro-1H-inden-1-ol
PubChem CID79374018
Molecular FormulaC16H15FO3
Molecular Weight274.29 g/mol
Exact Mass274.10
IUPAC Name2-(4-fluorophenoxy)-6-methoxy-2,3-dihydro-1H-inden-1-ol
SMILESCOc1ccc2c(c1)C(O)C(Oc1ccc(F)cc1)C2
InChIInChI=1S/C16H15FO3/c1-19-13-5-2-10-8-15(16(18)14(10)9-13)20-12-6-3-11(17)4-7-12/h2-7,9,15-16,18H,8H2,1H3
InChIKeyHEVTWSMMYATOKP-UHFFFAOYSA-N
XLogP2.87
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.29
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(5-fluoro-2-methylphenoxy)-6-methoxy-2,3-dihydro-1H-inden-1-ol
CID 102983334
2-(3,5-dimethylphenoxy)-6-methoxy-2,3-dihydro-1H-inden-1-ol
CID 79372409
2-(2-fluoro-3-methylphenoxy)-6-methoxy-2,3-dihydro-1H-inden-1-ol
CID 107660304
2-(2,5-dimethylphenoxy)-6-methoxy-2,3-dihydro-1H-inden-1-ol
CID 79372407
2-(4-fluorophenoxy)-7-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine
CID 79235063
2-(3,4-dimethylcyclohexyl)oxy-6-methoxy-2,3-dihydro-1H-inden-1-ol
CID 79372422
2-(5-fluoro-2-methylphenoxy)-6-methoxy-2,3-dihydro-1H-inden-1-amine
CID 102981057
6-methoxy-N-methyl-2-(3-methylphenoxy)-2,3-dihydro-1H-inden-1-amine
CID 79370320
6-methoxy-2-[methyl(2,2,2-trifluoroethyl)amino]-2,3-dihydro-1H-inden-1-ol
CID 79374795
7-methoxy-2-(2,2,2-trifluoroethoxy)-1,2,3,4-tetrahydronaphthalen-1-ol
CID 79248625
(1S,2R)-2-benzyl-6-methoxy-2,3-dihydro-1H-inden-1-ol
CID 129404140
2-[ethyl(2,2,2-trifluoroethyl)amino]-6-methoxy-2,3-dihydro-1H-inden-1-ol
CID 79375006

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenoxy)-6-methoxy-2,3-dihydro-1H-inden-1-ol?
The IUPAC name of 2-(4-fluorophenoxy)-6-methoxy-2,3-dihydro-1H-inden-1-ol (CID 79374018) is 2-(4-fluorophenoxy)-6-methoxy-2,3-dihydro-1H-inden-1-ol.
What is the SMILES notation for 2-(4-fluorophenoxy)-6-methoxy-2,3-dihydro-1H-inden-1-ol?
The canonical SMILES for 2-(4-fluorophenoxy)-6-methoxy-2,3-dihydro-1H-inden-1-ol is COc1ccc2c(c1)C(O)C(Oc1ccc(F)cc1)C2.
What is the InChIKey of 2-(4-fluorophenoxy)-6-methoxy-2,3-dihydro-1H-inden-1-ol?
The InChIKey is HEVTWSMMYATOKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15FO3/c1-19-13-5-2-10-8-15(16(18)14(10)9-13)20-12-6-3-11(17)4-7-12/h2-7,9,15-16,18H,8H2,1H3.
What are the key properties of 2-(4-fluorophenoxy)-6-methoxy-2,3-dihydro-1H-inden-1-ol?
2-(4-fluorophenoxy)-6-methoxy-2,3-dihydro-1H-inden-1-ol has a molecular weight of 274.29 g/mol, XLogP of 2.87, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenoxy)-6-methoxy-2,3-dihydro-1H-inden-1-ol is sourced from PubChem (CID 79374018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).