(5-fluoro-2-methylphenyl)-quinolin-8-ylsulfonylazanide

C16H12FN2O2S- — CID 5176779

IUPAC(5-fluoro-2-methylphenyl)-quinolin-8-ylsulfonylazanide
SMILESCc1ccc(F)cc1[N-]S(=O)(=O)c1cccc2cccnc12
InChIInChI=1S/C16H12FN2O2S/c1-11-7-8-13(17)10-14(11)19-22(20,21)15-6-2-4-12-5-3-9-18-16(12)15/h2-10H,1H3/q-1
InChIKeyIFMLJINDXBAARV-UHFFFAOYSA-N
MW315.35 g/mol
LogP4.08
Rot. Bonds3

About (5-fluoro-2-methylphenyl)-quinolin-8-ylsulfonylazanide

(5-fluoro-2-methylphenyl)-quinolin-8-ylsulfonylazanide (PubChem CID 5176779) has the molecular formula C16H12FN2O2S- and a molecular weight of 315.35 g/mol. Its IUPAC name is (5-fluoro-2-methylphenyl)-quinolin-8-ylsulfonylazanide.

Molecular Properties

Compound Name(5-fluoro-2-methylphenyl)-quinolin-8-ylsulfonylazanide
PubChem CID5176779
Molecular FormulaC16H12FN2O2S-
Molecular Weight315.35 g/mol
Exact Mass315.06
IUPAC Name(5-fluoro-2-methylphenyl)-quinolin-8-ylsulfonylazanide
SMILESCc1ccc(F)cc1[N-]S(=O)(=O)c1cccc2cccnc12
InChIInChI=1S/C16H12FN2O2S/c1-11-7-8-13(17)10-14(11)19-22(20,21)15-6-2-4-12-5-3-9-18-16(12)15/h2-10H,1H3/q-1
InChIKeyIFMLJINDXBAARV-UHFFFAOYSA-N
XLogP4.08
TPSA61.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.35
LogP ≤ 54.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

sodium [4-fluoro-2-[[(1S)-1-phenylpropyl]carbamoyl]phenyl]-quinolin-8-ylsulfonylazanide
CID 24852044
naphthalen-1-ylsulfonyl(quinolin-8-yl)azanide;zinc
CID 22974317
N-(2,5-difluorophenyl)quinoline-8-sulfonamide
CID 22773481
N-[(3-fluoro-4-methylphenyl)methyl]quinoline-8-sulfonamide
CID 4685114
8-methylsulfanylsulfonylquinoline
CID 913226
methylsulfonyl(quinolin-8-yl)azanide
CID 25244687
5-fluoro-2-(quinolin-8-ylsulfonylamino)benzoic acid
CID 22398672
N-(2,4-dimethylphenyl)quinoline-8-sulfonamide
CID 4067742
6-methylquinoline-8-sulfonyl fluoride
CID 165453594
N-[5-(hydroxymethyl)-2-methylphenyl]quinoline-8-sulfonamide
CID 3338850
N,N-bis(4-methylphenyl)quinoline-8-sulfonamide
CID 3737417
N-(2-methylpropyl)quinoline-8-sulfonamide
CID 19681190

Frequently Asked Questions

What is the IUPAC name of (5-fluoro-2-methylphenyl)-quinolin-8-ylsulfonylazanide?
The IUPAC name of (5-fluoro-2-methylphenyl)-quinolin-8-ylsulfonylazanide (CID 5176779) is (5-fluoro-2-methylphenyl)-quinolin-8-ylsulfonylazanide.
What is the SMILES notation for (5-fluoro-2-methylphenyl)-quinolin-8-ylsulfonylazanide?
The canonical SMILES for (5-fluoro-2-methylphenyl)-quinolin-8-ylsulfonylazanide is Cc1ccc(F)cc1[N-]S(=O)(=O)c1cccc2cccnc12.
What is the InChIKey of (5-fluoro-2-methylphenyl)-quinolin-8-ylsulfonylazanide?
The InChIKey is IFMLJINDXBAARV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12FN2O2S/c1-11-7-8-13(17)10-14(11)19-22(20,21)15-6-2-4-12-5-3-9-18-16(12)15/h2-10H,1H3/q-1.
What are the key properties of (5-fluoro-2-methylphenyl)-quinolin-8-ylsulfonylazanide?
(5-fluoro-2-methylphenyl)-quinolin-8-ylsulfonylazanide has a molecular weight of 315.35 g/mol, XLogP of 4.08, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-fluoro-2-methylphenyl)-quinolin-8-ylsulfonylazanide is sourced from PubChem (CID 5176779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).