2-(5-chloro-2-fluorophenyl)-1-(2,3-dihydro-1H-indol-7-yl)ethanol

C16H15ClFNO — CID 103047776

IUPAC2-(5-chloro-2-fluorophenyl)-1-(2,3-dihydro-1H-indol-7-yl)ethanol
SMILESOC(Cc1cc(Cl)ccc1F)c1cccc2c1NCC2
InChIInChI=1S/C16H15ClFNO/c17-12-4-5-14(18)11(8-12)9-15(20)13-3-1-2-10-6-7-19-16(10)13/h1-5,8,15,19-20H,6-7,9H2
InChIKeyOCCRJKSJKMDBCB-UHFFFAOYSA-N
MW291.75 g/mol
LogP3.72
Rot. Bonds3

About 2-(5-chloro-2-fluorophenyl)-1-(2,3-dihydro-1H-indol-7-yl)ethanol

2-(5-chloro-2-fluorophenyl)-1-(2,3-dihydro-1H-indol-7-yl)ethanol (PubChem CID 103047776) has the molecular formula C16H15ClFNO and a molecular weight of 291.75 g/mol. Its IUPAC name is 2-(5-chloro-2-fluorophenyl)-1-(2,3-dihydro-1H-indol-7-yl)ethanol.

Molecular Properties

Compound Name2-(5-chloro-2-fluorophenyl)-1-(2,3-dihydro-1H-indol-7-yl)ethanol
PubChem CID103047776
Molecular FormulaC16H15ClFNO
Molecular Weight291.75 g/mol
Exact Mass291.08
IUPAC Name2-(5-chloro-2-fluorophenyl)-1-(2,3-dihydro-1H-indol-7-yl)ethanol
SMILESOC(Cc1cc(Cl)ccc1F)c1cccc2c1NCC2
InChIInChI=1S/C16H15ClFNO/c17-12-4-5-14(18)11(8-12)9-15(20)13-3-1-2-10-6-7-19-16(10)13/h1-5,8,15,19-20H,6-7,9H2
InChIKeyOCCRJKSJKMDBCB-UHFFFAOYSA-N
XLogP3.72
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.75
LogP ≤ 53.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

7-[2-(5-chloro-2-fluorophenyl)-1-fluoroethyl]-2,3-dihydro-1H-indole
CID 103052163
2-(2-chloro-4-methylphenyl)-1-(2,3-dihydro-1H-indol-7-yl)ethanol
CID 106866608
1-(3-chloro-2-fluorophenyl)-2-(5-chloro-2-fluorophenyl)ethanol
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2-(5-chloro-2-fluorophenyl)-1-(5-fluoro-2-methylphenyl)ethanol
CID 103048202
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CID 103048252
2-(5-chloro-2-fluorophenyl)-1-[2-(methoxymethyl)phenyl]ethanol
CID 103047666
1-(2-chlorophenyl)-2-(2,5-difluorophenyl)ethanol
CID 62099435
1-(3-chloro-2-fluorophenyl)-2-(2,5-difluorophenyl)ethanol
CID 64712609
2-(5-chloro-2-fluorophenyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanol
CID 103048254
2-(5-chloro-2-fluorophenyl)-1-pyridin-4-ylethanol
CID 103047540
1-(2-bromo-6-fluorophenyl)-2-(5-chloro-2-fluorophenyl)ethanol
CID 103048373
2-(5-bromo-2-fluorophenyl)-1-(2,3-dichlorophenyl)ethanol
CID 65148464

Frequently Asked Questions

What is the IUPAC name of 2-(5-chloro-2-fluorophenyl)-1-(2,3-dihydro-1H-indol-7-yl)ethanol?
The IUPAC name of 2-(5-chloro-2-fluorophenyl)-1-(2,3-dihydro-1H-indol-7-yl)ethanol (CID 103047776) is 2-(5-chloro-2-fluorophenyl)-1-(2,3-dihydro-1H-indol-7-yl)ethanol.
What is the SMILES notation for 2-(5-chloro-2-fluorophenyl)-1-(2,3-dihydro-1H-indol-7-yl)ethanol?
The canonical SMILES for 2-(5-chloro-2-fluorophenyl)-1-(2,3-dihydro-1H-indol-7-yl)ethanol is OC(Cc1cc(Cl)ccc1F)c1cccc2c1NCC2.
What is the InChIKey of 2-(5-chloro-2-fluorophenyl)-1-(2,3-dihydro-1H-indol-7-yl)ethanol?
The InChIKey is OCCRJKSJKMDBCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15ClFNO/c17-12-4-5-14(18)11(8-12)9-15(20)13-3-1-2-10-6-7-19-16(10)13/h1-5,8,15,19-20H,6-7,9H2.
What are the key properties of 2-(5-chloro-2-fluorophenyl)-1-(2,3-dihydro-1H-indol-7-yl)ethanol?
2-(5-chloro-2-fluorophenyl)-1-(2,3-dihydro-1H-indol-7-yl)ethanol has a molecular weight of 291.75 g/mol, XLogP of 3.72, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-chloro-2-fluorophenyl)-1-(2,3-dihydro-1H-indol-7-yl)ethanol is sourced from PubChem (CID 103047776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).