3-(4-fluorophenyl)sulfonyl-N-naphthalen-1-ylpropanamide

C19H16FNO3S — CID 7254373

IUPAC3-(4-fluorophenyl)sulfonyl-N-naphthalen-1-ylpropanamide
SMILESO=C(CCS(=O)(=O)c1ccc(F)cc1)Nc1cccc2ccccc12
InChIInChI=1S/C19H16FNO3S/c20-15-8-10-16(11-9-15)25(23,24)13-12-19(22)21-18-7-3-5-14-4-1-2-6-17(14)18/h1-11H,12-13H2,(H,21,22)
InChIKeyBOGQDQMLHVPMJY-UHFFFAOYSA-N
MW357.41 g/mol
LogP3.78
Rot. Bonds5

About 3-(4-fluorophenyl)sulfonyl-N-naphthalen-1-ylpropanamide

3-(4-fluorophenyl)sulfonyl-N-naphthalen-1-ylpropanamide (PubChem CID 7254373) has the molecular formula C19H16FNO3S and a molecular weight of 357.41 g/mol. Its IUPAC name is 3-(4-fluorophenyl)sulfonyl-N-naphthalen-1-ylpropanamide.

Molecular Properties

Compound Name3-(4-fluorophenyl)sulfonyl-N-naphthalen-1-ylpropanamide
PubChem CID7254373
Molecular FormulaC19H16FNO3S
Molecular Weight357.41 g/mol
Exact Mass357.08
IUPAC Name3-(4-fluorophenyl)sulfonyl-N-naphthalen-1-ylpropanamide
SMILESO=C(CCS(=O)(=O)c1ccc(F)cc1)Nc1cccc2ccccc12
InChIInChI=1S/C19H16FNO3S/c20-15-8-10-16(11-9-15)25(23,24)13-12-19(22)21-18-7-3-5-14-4-1-2-6-17(14)18/h1-11H,12-13H2,(H,21,22)
InChIKeyBOGQDQMLHVPMJY-UHFFFAOYSA-N
XLogP3.78
TPSA63.24 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.41
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1,2-dihydroacenaphthylen-5-yl)-3-(4-fluorophenyl)sulfonylpropanamide
CID 7544372
N-(9,10-dioxoanthracen-1-yl)-3-(4-fluorophenyl)sulfonylpropanamide
CID 41151686
3-methylsulfonyl-N-naphthalen-1-ylpropanamide
CID 127504646
N,N'-dinaphthalen-1-ylbutanediamide
CID 1346643
3-(4-acetamidophenyl)sulfonyl-N-(4-fluorophenyl)propanamide
CID 110420356
3-fluoro-N-naphthalen-1-ylpropanamide
CID 67224476
N-(2,5-dimethylphenyl)-3-(4-fluorophenyl)sulfonylpropanamide
CID 8702322
naphthalen-1-ylmethyl 3-(4-fluorophenyl)sulfonylpropanoate
CID 7624005
N-(4-bromophenyl)-3-(4-fluorophenyl)sulfonylpropanamide
CID 7544356
N-(2-aminophenyl)-3-(benzenesulfonyl)propanamide
CID 43444138
N-(2-benzoyl-4-methylphenyl)-2-[3-(4-fluorophenyl)sulfonylpropanoylamino]benzamide
CID 44994815
2-[(4-fluorophenyl)methyl-(4-methylphenyl)sulfonylamino]-N-naphthalen-1-ylacetamide
CID 126062395

Frequently Asked Questions

What is the IUPAC name of 3-(4-fluorophenyl)sulfonyl-N-naphthalen-1-ylpropanamide?
The IUPAC name of 3-(4-fluorophenyl)sulfonyl-N-naphthalen-1-ylpropanamide (CID 7254373) is 3-(4-fluorophenyl)sulfonyl-N-naphthalen-1-ylpropanamide.
What is the SMILES notation for 3-(4-fluorophenyl)sulfonyl-N-naphthalen-1-ylpropanamide?
The canonical SMILES for 3-(4-fluorophenyl)sulfonyl-N-naphthalen-1-ylpropanamide is O=C(CCS(=O)(=O)c1ccc(F)cc1)Nc1cccc2ccccc12.
What is the InChIKey of 3-(4-fluorophenyl)sulfonyl-N-naphthalen-1-ylpropanamide?
The InChIKey is BOGQDQMLHVPMJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16FNO3S/c20-15-8-10-16(11-9-15)25(23,24)13-12-19(22)21-18-7-3-5-14-4-1-2-6-17(14)18/h1-11H,12-13H2,(H,21,22).
What are the key properties of 3-(4-fluorophenyl)sulfonyl-N-naphthalen-1-ylpropanamide?
3-(4-fluorophenyl)sulfonyl-N-naphthalen-1-ylpropanamide has a molecular weight of 357.41 g/mol, XLogP of 3.78, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluorophenyl)sulfonyl-N-naphthalen-1-ylpropanamide is sourced from PubChem (CID 7254373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).