1-(4-methylphenyl)-N-[(R)-(2-methylphenyl)-phenylmethyl]methanesulfonamide

C22H23NO2S — CID 28573215

IUPAC1-(4-methylphenyl)-N-[(R)-(2-methylphenyl)-phenylmethyl]methanesulfonamide
SMILESCc1ccc(CS(=O)(=O)N[C@H](c2ccccc2)c2ccccc2C)cc1
InChIInChI=1S/C22H23NO2S/c1-17-12-14-19(15-13-17)16-26(24,25)23-22(20-9-4-3-5-10-20)21-11-7-6-8-18(21)2/h3-15,22-23H,16H2,1-2H3/t22-/m1/s1
InChIKeyGEPLRDIRKWONAT-JOCHJYFZSA-N
MW365.50 g/mol
LogP4.51
Rot. Bonds6

About 1-(4-methylphenyl)-N-[(R)-(2-methylphenyl)-phenylmethyl]methanesulfonamide

1-(4-methylphenyl)-N-[(R)-(2-methylphenyl)-phenylmethyl]methanesulfonamide (PubChem CID 28573215) has the molecular formula C22H23NO2S and a molecular weight of 365.50 g/mol. Its IUPAC name is 1-(4-methylphenyl)-N-[(R)-(2-methylphenyl)-phenylmethyl]methanesulfonamide.

Molecular Properties

Compound Name1-(4-methylphenyl)-N-[(R)-(2-methylphenyl)-phenylmethyl]methanesulfonamide
PubChem CID28573215
Molecular FormulaC22H23NO2S
Molecular Weight365.50 g/mol
Exact Mass365.14
IUPAC Name1-(4-methylphenyl)-N-[(R)-(2-methylphenyl)-phenylmethyl]methanesulfonamide
SMILESCc1ccc(CS(=O)(=O)N[C@H](c2ccccc2)c2ccccc2C)cc1
InChIInChI=1S/C22H23NO2S/c1-17-12-14-19(15-13-17)16-26(24,25)23-22(20-9-4-3-5-10-20)21-11-7-6-8-18(21)2/h3-15,22-23H,16H2,1-2H3/t22-/m1/s1
InChIKeyGEPLRDIRKWONAT-JOCHJYFZSA-N
XLogP4.51
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.50
LogP ≤ 54.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-fluorophenyl)-N-[(S)-(2-methylphenyl)-phenylmethyl]methanesulfonamide
CID 92683979
1-(3,4-dichlorophenyl)-N-[(4-methylphenyl)-phenylmethyl]methanesulfonamide
CID 43915985
2-(4-methylphenyl)-N-[(S)-(2-methylphenyl)-phenylmethyl]acetamide
CID 93487393
2-[(4-methylphenyl)methyl-methylsulfonylamino]-N-[(R)-(2-methylphenyl)-phenylmethyl]acetamide
CID 125054386
N-[(S)-(2,4-dimethylphenyl)-phenylmethyl]methanesulfonamide
CID 95706524
N-[(2S)-2-methoxy-2-(2-methylphenyl)ethyl]-1-phenylmethanesulfonamide
CID 97417781
N-[(1S)-2-methyl-1-phenylpropyl]-1-phenylmethanesulfonamide
CID 33038977
N-[(4-methylphenyl)methylsulfonyl]-2-phenylbutanamide
CID 130327231
3-[(2,4-dioxopyrimidin-1-yl)methoxy]-N-[(2-methylphenyl)-phenylmethyl]propane-1-sulfonamide
CID 67022128
N-[2-(4-methylphenyl)ethyl]-1-phenylmethanesulfonamide
CID 110787220
5-bromo-N-[(R)-(2-methylphenyl)-phenylmethyl]thiophene-2-sulfonamide
CID 93486397
2,5-dichloro-N-[(R)-(2-methylphenyl)-phenylmethyl]benzenesulfonamide
CID 92646276

Frequently Asked Questions

What is the IUPAC name of 1-(4-methylphenyl)-N-[(R)-(2-methylphenyl)-phenylmethyl]methanesulfonamide?
The IUPAC name of 1-(4-methylphenyl)-N-[(R)-(2-methylphenyl)-phenylmethyl]methanesulfonamide (CID 28573215) is 1-(4-methylphenyl)-N-[(R)-(2-methylphenyl)-phenylmethyl]methanesulfonamide.
What is the SMILES notation for 1-(4-methylphenyl)-N-[(R)-(2-methylphenyl)-phenylmethyl]methanesulfonamide?
The canonical SMILES for 1-(4-methylphenyl)-N-[(R)-(2-methylphenyl)-phenylmethyl]methanesulfonamide is Cc1ccc(CS(=O)(=O)N[C@H](c2ccccc2)c2ccccc2C)cc1.
What is the InChIKey of 1-(4-methylphenyl)-N-[(R)-(2-methylphenyl)-phenylmethyl]methanesulfonamide?
The InChIKey is GEPLRDIRKWONAT-JOCHJYFZSA-N. The full InChI is InChI=1S/C22H23NO2S/c1-17-12-14-19(15-13-17)16-26(24,25)23-22(20-9-4-3-5-10-20)21-11-7-6-8-18(21)2/h3-15,22-23H,16H2,1-2H3/t22-/m1/s1.
What are the key properties of 1-(4-methylphenyl)-N-[(R)-(2-methylphenyl)-phenylmethyl]methanesulfonamide?
1-(4-methylphenyl)-N-[(R)-(2-methylphenyl)-phenylmethyl]methanesulfonamide has a molecular weight of 365.50 g/mol, XLogP of 4.51, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methylphenyl)-N-[(R)-(2-methylphenyl)-phenylmethyl]methanesulfonamide is sourced from PubChem (CID 28573215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).