1-(2-fluorophenyl)-N-[(S)-(2-methylphenyl)-phenylmethyl]methanesulfonamide

C21H20FNO2S — CID 92683979

IUPAC1-(2-fluorophenyl)-N-[(S)-(2-methylphenyl)-phenylmethyl]methanesulfonamide
SMILESCc1ccccc1[C@@H](NS(=O)(=O)Cc1ccccc1F)c1ccccc1
InChIInChI=1S/C21H20FNO2S/c1-16-9-5-7-13-19(16)21(17-10-3-2-4-11-17)23-26(24,25)15-18-12-6-8-14-20(18)22/h2-14,21,23H,15H2,1H3/t21-/m0/s1
InChIKeyYVOGPWKKUIAUKD-NRFANRHFSA-N
MW369.46 g/mol
LogP4.34
Rot. Bonds6

About 1-(2-fluorophenyl)-N-[(S)-(2-methylphenyl)-phenylmethyl]methanesulfonamide

1-(2-fluorophenyl)-N-[(S)-(2-methylphenyl)-phenylmethyl]methanesulfonamide (PubChem CID 92683979) has the molecular formula C21H20FNO2S and a molecular weight of 369.46 g/mol. Its IUPAC name is 1-(2-fluorophenyl)-N-[(S)-(2-methylphenyl)-phenylmethyl]methanesulfonamide.

Molecular Properties

Compound Name1-(2-fluorophenyl)-N-[(S)-(2-methylphenyl)-phenylmethyl]methanesulfonamide
PubChem CID92683979
Molecular FormulaC21H20FNO2S
Molecular Weight369.46 g/mol
Exact Mass369.12
IUPAC Name1-(2-fluorophenyl)-N-[(S)-(2-methylphenyl)-phenylmethyl]methanesulfonamide
SMILESCc1ccccc1[C@@H](NS(=O)(=O)Cc1ccccc1F)c1ccccc1
InChIInChI=1S/C21H20FNO2S/c1-16-9-5-7-13-19(16)21(17-10-3-2-4-11-17)23-26(24,25)15-18-12-6-8-14-20(18)22/h2-14,21,23H,15H2,1H3/t21-/m0/s1
InChIKeyYVOGPWKKUIAUKD-NRFANRHFSA-N
XLogP4.34
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.46
LogP ≤ 54.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-methylphenyl)-N-[(R)-(2-methylphenyl)-phenylmethyl]methanesulfonamide
CID 28573215
1-(2-fluorophenyl)-N-[(1R)-1-(4-methylphenyl)ethyl]methanesulfonamide
CID 93487203
1-[(2-fluorophenyl)methylsulfonyl]-N-[(S)-(2-methylphenyl)-phenylmethyl]piperidine-4-carboxamide
CID 92675568
1-(2-fluorophenyl)-N-[(2R)-3-methylbutan-2-yl]methanesulfonamide
CID 100567034
1-(2-fluorophenyl)-N-[(1R)-1-(4-fluorophenyl)ethyl]methanesulfonamide
CID 93487236
N-[1-(4-ethylphenyl)ethyl]-1-(2-fluorophenyl)methanesulfonamide
CID 127508935
1-(2-fluorophenyl)-N-[2-(methylamino)propyl]methanesulfonamide
CID 120824821
2-[(2-fluorophenyl)methylsulfonylamino]-N-(1-phenylethyl)acetamide
CID 21148291
2,5-dichloro-N-[(R)-(2-methylphenyl)-phenylmethyl]benzenesulfonamide
CID 92646276
2-methyl-N-[5-[[(2-methylphenyl)-phenylmethyl]sulfamoyl]-2-methylsulfanylphenyl]propanamide
CID 133235759
2-methyl-N-[(S)-(2-methylphenyl)-phenylmethyl]propanamide
CID 100583680
1-(2-chloro-6-fluorophenyl)-N-[(1R)-1-phenylethyl]methanesulfonamide
CID 42563699

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorophenyl)-N-[(S)-(2-methylphenyl)-phenylmethyl]methanesulfonamide?
The IUPAC name of 1-(2-fluorophenyl)-N-[(S)-(2-methylphenyl)-phenylmethyl]methanesulfonamide (CID 92683979) is 1-(2-fluorophenyl)-N-[(S)-(2-methylphenyl)-phenylmethyl]methanesulfonamide.
What is the SMILES notation for 1-(2-fluorophenyl)-N-[(S)-(2-methylphenyl)-phenylmethyl]methanesulfonamide?
The canonical SMILES for 1-(2-fluorophenyl)-N-[(S)-(2-methylphenyl)-phenylmethyl]methanesulfonamide is Cc1ccccc1[C@@H](NS(=O)(=O)Cc1ccccc1F)c1ccccc1.
What is the InChIKey of 1-(2-fluorophenyl)-N-[(S)-(2-methylphenyl)-phenylmethyl]methanesulfonamide?
The InChIKey is YVOGPWKKUIAUKD-NRFANRHFSA-N. The full InChI is InChI=1S/C21H20FNO2S/c1-16-9-5-7-13-19(16)21(17-10-3-2-4-11-17)23-26(24,25)15-18-12-6-8-14-20(18)22/h2-14,21,23H,15H2,1H3/t21-/m0/s1.
What are the key properties of 1-(2-fluorophenyl)-N-[(S)-(2-methylphenyl)-phenylmethyl]methanesulfonamide?
1-(2-fluorophenyl)-N-[(S)-(2-methylphenyl)-phenylmethyl]methanesulfonamide has a molecular weight of 369.46 g/mol, XLogP of 4.34, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)-N-[(S)-(2-methylphenyl)-phenylmethyl]methanesulfonamide is sourced from PubChem (CID 92683979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).