1-(2-fluorophenyl)sulfonyl-3,4-dihydro-2H-quinolin-8-ol

C15H14FNO3S — CID 63215606

IUPAC1-(2-fluorophenyl)sulfonyl-3,4-dihydro-2H-quinolin-8-ol
SMILESO=S(=O)(c1ccccc1F)N1CCCc2cccc(O)c21
InChIInChI=1S/C15H14FNO3S/c16-12-7-1-2-9-14(12)21(19,20)17-10-4-6-11-5-3-8-13(18)15(11)17/h1-3,5,7-9,18H,4,6,10H2
InChIKeyFWMWMQCMWWJXRZ-UHFFFAOYSA-N
MW307.35 g/mol
LogP2.67
Rot. Bonds2

About 1-(2-fluorophenyl)sulfonyl-3,4-dihydro-2H-quinolin-8-ol

1-(2-fluorophenyl)sulfonyl-3,4-dihydro-2H-quinolin-8-ol (PubChem CID 63215606) has the molecular formula C15H14FNO3S and a molecular weight of 307.35 g/mol. Its IUPAC name is 1-(2-fluorophenyl)sulfonyl-3,4-dihydro-2H-quinolin-8-ol.

Molecular Properties

Compound Name1-(2-fluorophenyl)sulfonyl-3,4-dihydro-2H-quinolin-8-ol
PubChem CID63215606
Molecular FormulaC15H14FNO3S
Molecular Weight307.35 g/mol
Exact Mass307.07
IUPAC Name1-(2-fluorophenyl)sulfonyl-3,4-dihydro-2H-quinolin-8-ol
SMILESO=S(=O)(c1ccccc1F)N1CCCc2cccc(O)c21
InChIInChI=1S/C15H14FNO3S/c16-12-7-1-2-9-14(12)21(19,20)17-10-4-6-11-5-3-8-13(18)15(11)17/h1-3,5,7-9,18H,4,6,10H2
InChIKeyFWMWMQCMWWJXRZ-UHFFFAOYSA-N
XLogP2.67
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.35
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorophenyl)sulfonyl-3,4-dihydro-2H-quinolin-8-ol?
The IUPAC name of 1-(2-fluorophenyl)sulfonyl-3,4-dihydro-2H-quinolin-8-ol (CID 63215606) is 1-(2-fluorophenyl)sulfonyl-3,4-dihydro-2H-quinolin-8-ol.
What is the SMILES notation for 1-(2-fluorophenyl)sulfonyl-3,4-dihydro-2H-quinolin-8-ol?
The canonical SMILES for 1-(2-fluorophenyl)sulfonyl-3,4-dihydro-2H-quinolin-8-ol is O=S(=O)(c1ccccc1F)N1CCCc2cccc(O)c21.
What is the InChIKey of 1-(2-fluorophenyl)sulfonyl-3,4-dihydro-2H-quinolin-8-ol?
The InChIKey is FWMWMQCMWWJXRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14FNO3S/c16-12-7-1-2-9-14(12)21(19,20)17-10-4-6-11-5-3-8-13(18)15(11)17/h1-3,5,7-9,18H,4,6,10H2.
What are the key properties of 1-(2-fluorophenyl)sulfonyl-3,4-dihydro-2H-quinolin-8-ol?
1-(2-fluorophenyl)sulfonyl-3,4-dihydro-2H-quinolin-8-ol has a molecular weight of 307.35 g/mol, XLogP of 2.67, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)sulfonyl-3,4-dihydro-2H-quinolin-8-ol is sourced from PubChem (CID 63215606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).