N-[(4-phenylphenyl)methyl]sulfamoyl fluoride

C13H12FNO2S — CID 138664404

IUPACN-[(4-phenylphenyl)methyl]sulfamoyl fluoride
SMILESO=S(=O)(F)NCc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C13H12FNO2S/c14-18(16,17)15-10-11-6-8-13(9-7-11)12-4-2-1-3-5-12/h1-9,15H,10H2
InChIKeyJDLHAUQFPUJHMQ-UHFFFAOYSA-N
MW265.31 g/mol
LogP2.66
Rot. Bonds4

About N-[(4-phenylphenyl)methyl]sulfamoyl fluoride

N-[(4-phenylphenyl)methyl]sulfamoyl fluoride (PubChem CID 138664404) has the molecular formula C13H12FNO2S and a molecular weight of 265.31 g/mol. Its IUPAC name is N-[(4-phenylphenyl)methyl]sulfamoyl fluoride.

Molecular Properties

Compound NameN-[(4-phenylphenyl)methyl]sulfamoyl fluoride
PubChem CID138664404
Molecular FormulaC13H12FNO2S
Molecular Weight265.31 g/mol
Exact Mass265.06
IUPAC NameN-[(4-phenylphenyl)methyl]sulfamoyl fluoride
SMILESO=S(=O)(F)NCc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C13H12FNO2S/c14-18(16,17)15-10-11-6-8-13(9-7-11)12-4-2-1-3-5-12/h1-9,15H,10H2
InChIKeyJDLHAUQFPUJHMQ-UHFFFAOYSA-N
XLogP2.66
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(4-phenylphenyl)methyl]ethanesulfonamide
CID 110781116
N-[(4-methylphenyl)methylsulfamoyl]-1-phenylmethanamine
CID 1488551
[(4-phenylphenyl)methylamino] thiohypofluorite
CID 138664405
N-[(4-phenylphenyl)methyl]formamide
CID 54112237
2-ethylsulfonyl-N-[(4-phenylphenyl)methyl]ethanamine
CID 103643079
N-[(4-phenylphenyl)methyl]-1H-indole-2-sulfonamide
CID 66547075
N-[(4-phenylphenyl)methyl]aniline
CID 10658964
(4-phenylphenyl)methylhydrazine;hydrochloride
CID 71432751
benzylsulfamic acid;ethane
CID 154691965
N,N'-bis[(4-phenylphenyl)methyl]butane-1,4-diamine
CID 10273675
N-(bromomethyl)-1-(4-phenylphenyl)methanamine
CID 115261872
CID 70601747
CID 70601747

Frequently Asked Questions

What is the IUPAC name of N-[(4-phenylphenyl)methyl]sulfamoyl fluoride?
The IUPAC name of N-[(4-phenylphenyl)methyl]sulfamoyl fluoride (CID 138664404) is N-[(4-phenylphenyl)methyl]sulfamoyl fluoride.
What is the SMILES notation for N-[(4-phenylphenyl)methyl]sulfamoyl fluoride?
The canonical SMILES for N-[(4-phenylphenyl)methyl]sulfamoyl fluoride is O=S(=O)(F)NCc1ccc(-c2ccccc2)cc1.
What is the InChIKey of N-[(4-phenylphenyl)methyl]sulfamoyl fluoride?
The InChIKey is JDLHAUQFPUJHMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12FNO2S/c14-18(16,17)15-10-11-6-8-13(9-7-11)12-4-2-1-3-5-12/h1-9,15H,10H2.
What are the key properties of N-[(4-phenylphenyl)methyl]sulfamoyl fluoride?
N-[(4-phenylphenyl)methyl]sulfamoyl fluoride has a molecular weight of 265.31 g/mol, XLogP of 2.66, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-phenylphenyl)methyl]sulfamoyl fluoride is sourced from PubChem (CID 138664404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).