N-(3-fluoro-2-hydroxyphenyl)naphthalene-2-sulfonamide

C16H12FNO3S — CID 150166464

IUPACN-(3-fluoro-2-hydroxyphenyl)naphthalene-2-sulfonamide
SMILESO=S(=O)(Nc1cccc(F)c1O)c1ccc2ccccc2c1
InChIInChI=1S/C16H12FNO3S/c17-14-6-3-7-15(16(14)19)18-22(20,21)13-9-8-11-4-1-2-5-12(11)10-13/h1-10,18-19H
InChIKeyFIMUVUJENJMIEE-UHFFFAOYSA-N
MW317.34 g/mol
LogP3.49
Rot. Bonds3

About N-(3-fluoro-2-hydroxyphenyl)naphthalene-2-sulfonamide

N-(3-fluoro-2-hydroxyphenyl)naphthalene-2-sulfonamide (PubChem CID 150166464) has the molecular formula C16H12FNO3S and a molecular weight of 317.34 g/mol. Its IUPAC name is N-(3-fluoro-2-hydroxyphenyl)naphthalene-2-sulfonamide.

Molecular Properties

Compound NameN-(3-fluoro-2-hydroxyphenyl)naphthalene-2-sulfonamide
PubChem CID150166464
Molecular FormulaC16H12FNO3S
Molecular Weight317.34 g/mol
Exact Mass317.05
IUPAC NameN-(3-fluoro-2-hydroxyphenyl)naphthalene-2-sulfonamide
SMILESO=S(=O)(Nc1cccc(F)c1O)c1ccc2ccccc2c1
InChIInChI=1S/C16H12FNO3S/c17-14-6-3-7-15(16(14)19)18-22(20,21)13-9-8-11-4-1-2-5-12(11)10-13/h1-10,18-19H
InChIKeyFIMUVUJENJMIEE-UHFFFAOYSA-N
XLogP3.49
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.34
LogP ≤ 53.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'catechol', 'substructure': 'N/A'}

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Related Compounds

N-[5-(naphthalen-2-ylsulfonylamino)naphthalen-1-yl]naphthalene-2-sulfonamide
CID 3407912
N-(2,5-difluorophenyl)naphthalene-2-sulfonamide
CID 22773480
N-(2,3,4-trifluorophenyl)naphthalene-2-sulfonamide
CID 9464601
N-(2-methylphenyl)naphthalene-2-sulfonamide
CID 3308551
N-(2-nitrophenyl)naphthalene-2-sulfonamide
CID 19203612
N-(3,5-dichloro-4-hydroxyphenyl)naphthalene-2-sulfonamide
CID 1137620
N-(5-ethylsulfonyl-2-hydroxyphenyl)naphthalene-2-sulfonamide
CID 2439926
2-[(6-methylnaphthalen-2-yl)sulfonylamino]benzoate
CID 7573844
3-amino-N-(2,3-difluorophenyl)-4-hydroxybenzenesulfonamide
CID 61076963
N-(2-phenylsulfanylphenyl)naphthalene-2-sulfonamide
CID 5025961
N-[4-[(2,3-dichlorophenyl)sulfamoyl]phenyl]naphthalene-2-sulfonamide
CID 126387209
N-(5-nitronaphthalen-1-yl)naphthalene-2-sulfonamide
CID 2945239

Frequently Asked Questions

What is the IUPAC name of N-(3-fluoro-2-hydroxyphenyl)naphthalene-2-sulfonamide?
The IUPAC name of N-(3-fluoro-2-hydroxyphenyl)naphthalene-2-sulfonamide (CID 150166464) is N-(3-fluoro-2-hydroxyphenyl)naphthalene-2-sulfonamide.
What is the SMILES notation for N-(3-fluoro-2-hydroxyphenyl)naphthalene-2-sulfonamide?
The canonical SMILES for N-(3-fluoro-2-hydroxyphenyl)naphthalene-2-sulfonamide is O=S(=O)(Nc1cccc(F)c1O)c1ccc2ccccc2c1.
What is the InChIKey of N-(3-fluoro-2-hydroxyphenyl)naphthalene-2-sulfonamide?
The InChIKey is FIMUVUJENJMIEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12FNO3S/c17-14-6-3-7-15(16(14)19)18-22(20,21)13-9-8-11-4-1-2-5-12(11)10-13/h1-10,18-19H.
What are the key properties of N-(3-fluoro-2-hydroxyphenyl)naphthalene-2-sulfonamide?
N-(3-fluoro-2-hydroxyphenyl)naphthalene-2-sulfonamide has a molecular weight of 317.34 g/mol, XLogP of 3.49, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluoro-2-hydroxyphenyl)naphthalene-2-sulfonamide is sourced from PubChem (CID 150166464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).