2,3-dihydro-1H-inden-5-yl-(2-fluoro-6-methoxyphenyl)methanol

C17H17FO2 — CID 65434633

IUPAC2,3-dihydro-1H-inden-5-yl-(2-fluoro-6-methoxyphenyl)methanol
SMILESCOc1cccc(F)c1C(O)c1ccc2c(c1)CCC2
InChIInChI=1S/C17H17FO2/c1-20-15-7-3-6-14(18)16(15)17(19)13-9-8-11-4-2-5-12(11)10-13/h3,6-10,17,19H,2,4-5H2,1H3
InChIKeyKZTNXMBYHCNXCK-UHFFFAOYSA-N
MW272.32 g/mol
LogP3.40
Rot. Bonds3

About 2,3-dihydro-1H-inden-5-yl-(2-fluoro-6-methoxyphenyl)methanol

2,3-dihydro-1H-inden-5-yl-(2-fluoro-6-methoxyphenyl)methanol (PubChem CID 65434633) has the molecular formula C17H17FO2 and a molecular weight of 272.32 g/mol. Its IUPAC name is 2,3-dihydro-1H-inden-5-yl-(2-fluoro-6-methoxyphenyl)methanol.

Molecular Properties

Compound Name2,3-dihydro-1H-inden-5-yl-(2-fluoro-6-methoxyphenyl)methanol
PubChem CID65434633
Molecular FormulaC17H17FO2
Molecular Weight272.32 g/mol
Exact Mass272.12
IUPAC Name2,3-dihydro-1H-inden-5-yl-(2-fluoro-6-methoxyphenyl)methanol
SMILESCOc1cccc(F)c1C(O)c1ccc2c(c1)CCC2
InChIInChI=1S/C17H17FO2/c1-20-15-7-3-6-14(18)16(15)17(19)13-9-8-11-4-2-5-12(11)10-13/h3,6-10,17,19H,2,4-5H2,1H3
InChIKeyKZTNXMBYHCNXCK-UHFFFAOYSA-N
XLogP3.40
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.32
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2,3-dihydro-1H-inden-5-yl-(2-fluoro-6-methoxyphenyl)methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2-fluoro-6-methoxyphenyl)-(4-fluoro-3-methylphenyl)methanol
CID 79747390
(3-bromo-4-fluorophenyl)-(2-fluoro-6-methoxyphenyl)methanol
CID 79746374
2,3-dihydro-1H-inden-5-yl-(4-fluorophenyl)methanol
CID 61100715
(4-chloro-3-methoxyphenyl)-(2,3-dihydro-1H-inden-5-yl)methanol
CID 115818011
(3-cyclopropyloxyphenyl)-(2-fluoro-6-methoxyphenyl)methanol
CID 114521405
(2,6-dimethoxyphenyl)-(3-fluoro-4-methylphenyl)methanol
CID 116809700
(2,6-difluorophenyl)-(2,3-dihydro-1H-inden-5-yl)methanamine
CID 43115569
5-[bromo-(3-fluoro-4-methoxyphenyl)methyl]-2,3-dihydro-1H-indene
CID 63440402
(3-chloro-4-methoxyphenyl)-(2,6-difluorophenyl)methanol
CID 61099841
(2-fluoro-6-methoxyphenyl)-(5-methyl-3-pyridinyl)methanol
CID 115374206
2-(2,3-dihydro-1H-inden-5-yl)-1-(3-fluoro-4-methoxyphenyl)ethanol
CID 65101112
1-(1,3-dihydro-2-benzofuran-5-yl)-1-(2-fluoro-6-methoxyphenyl)-N-methylmethanamine
CID 65434782

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-1H-inden-5-yl-(2-fluoro-6-methoxyphenyl)methanol?
The IUPAC name of 2,3-dihydro-1H-inden-5-yl-(2-fluoro-6-methoxyphenyl)methanol (CID 65434633) is 2,3-dihydro-1H-inden-5-yl-(2-fluoro-6-methoxyphenyl)methanol.
What is the SMILES notation for 2,3-dihydro-1H-inden-5-yl-(2-fluoro-6-methoxyphenyl)methanol?
The canonical SMILES for 2,3-dihydro-1H-inden-5-yl-(2-fluoro-6-methoxyphenyl)methanol is COc1cccc(F)c1C(O)c1ccc2c(c1)CCC2.
What is the InChIKey of 2,3-dihydro-1H-inden-5-yl-(2-fluoro-6-methoxyphenyl)methanol?
The InChIKey is KZTNXMBYHCNXCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17FO2/c1-20-15-7-3-6-14(18)16(15)17(19)13-9-8-11-4-2-5-12(11)10-13/h3,6-10,17,19H,2,4-5H2,1H3.
What are the key properties of 2,3-dihydro-1H-inden-5-yl-(2-fluoro-6-methoxyphenyl)methanol?
2,3-dihydro-1H-inden-5-yl-(2-fluoro-6-methoxyphenyl)methanol has a molecular weight of 272.32 g/mol, XLogP of 3.40, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydro-1H-inden-5-yl-(2-fluoro-6-methoxyphenyl)methanol is sourced from PubChem (CID 65434633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).