N-(2-amino-1,2-diphenylethyl)-1-naphthalen-2-ylmethanesulfonamide

C25H24N2O2S — CID 59537514

IUPACN-(2-amino-1,2-diphenylethyl)-1-naphthalen-2-ylmethanesulfonamide
SMILESNC(c1ccccc1)C(NS(=O)(=O)Cc1ccc2ccccc2c1)c1ccccc1
InChIInChI=1S/C25H24N2O2S/c26-24(21-10-3-1-4-11-21)25(22-12-5-2-6-13-22)27-30(28,29)18-19-15-16-20-9-7-8-14-23(20)17-19/h1-17,24-25,27H,18,26H2
InChIKeySJOGNAIKGLXPLC-UHFFFAOYSA-N
MW416.55 g/mol
LogP4.70
Rot. Bonds7

About N-(2-amino-1,2-diphenylethyl)-1-naphthalen-2-ylmethanesulfonamide

N-(2-amino-1,2-diphenylethyl)-1-naphthalen-2-ylmethanesulfonamide (PubChem CID 59537514) has the molecular formula C25H24N2O2S and a molecular weight of 416.55 g/mol. Its IUPAC name is N-(2-amino-1,2-diphenylethyl)-1-naphthalen-2-ylmethanesulfonamide.

Molecular Properties

Compound NameN-(2-amino-1,2-diphenylethyl)-1-naphthalen-2-ylmethanesulfonamide
PubChem CID59537514
Molecular FormulaC25H24N2O2S
Molecular Weight416.55 g/mol
Exact Mass416.16
IUPAC NameN-(2-amino-1,2-diphenylethyl)-1-naphthalen-2-ylmethanesulfonamide
SMILESNC(c1ccccc1)C(NS(=O)(=O)Cc1ccc2ccccc2c1)c1ccccc1
InChIInChI=1S/C25H24N2O2S/c26-24(21-10-3-1-4-11-21)25(22-12-5-2-6-13-22)27-30(28,29)18-19-15-16-20-9-7-8-14-23(20)17-19/h1-17,24-25,27H,18,26H2
InChIKeySJOGNAIKGLXPLC-UHFFFAOYSA-N
XLogP4.70
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500416.55
LogP ≤ 54.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-amino-1,2-diphenylethyl)-1-(3,5-diphenylphenyl)methanesulfonamide
CID 59537367
N-(2-amino-1,2-diphenylethyl)-1-(4-phenylphenyl)methanesulfonamide
CID 59537666
N-(2-amino-1,2-diphenylethyl)-1-(4-chlorophenyl)methanesulfonamide
CID 59537526
N-(2-amino-1,2-diphenylethyl)-1-(3-chlorophenyl)methanesulfonamide
CID 59537632
N-(2-amino-1,2-diphenylethyl)-1-(3-methoxyphenyl)methanesulfonamide
CID 59537325
N-(2-amino-1,2-diphenylethyl)-1-[3-(trifluoromethyl)phenyl]methanesulfonamide
CID 59537440
N-(2-amino-1,2-diphenylethyl)-1-[3,5-bis(trifluoromethyl)phenyl]methanesulfonamide
CID 59537598
N-[(1R,2R)-2-amino-1,2-diphenylethyl]naphthalene-2-sulfonamide;benzene;ruthenium
CID 87738093
N-(2-amino-1,2-diphenylethyl)-1-(2-methylnaphthalen-1-yl)methanesulfonamide
CID 59537297
N-(2-amino-1,2-diphenylethyl)-1-(2,6-diphenylphenyl)methanesulfonamide
CID 59537660
N-[(1R,2R)-2-amino-1,2-diphenylethyl]-2-(4-phenylphenyl)ethanesulfonamide
CID 102080788
N-(2-amino-1,2-diphenylethyl)-1-(2-phenylphenyl)methanesulfonamide
CID 59537380

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-1,2-diphenylethyl)-1-naphthalen-2-ylmethanesulfonamide?
The IUPAC name of N-(2-amino-1,2-diphenylethyl)-1-naphthalen-2-ylmethanesulfonamide (CID 59537514) is N-(2-amino-1,2-diphenylethyl)-1-naphthalen-2-ylmethanesulfonamide.
What is the SMILES notation for N-(2-amino-1,2-diphenylethyl)-1-naphthalen-2-ylmethanesulfonamide?
The canonical SMILES for N-(2-amino-1,2-diphenylethyl)-1-naphthalen-2-ylmethanesulfonamide is NC(c1ccccc1)C(NS(=O)(=O)Cc1ccc2ccccc2c1)c1ccccc1.
What is the InChIKey of N-(2-amino-1,2-diphenylethyl)-1-naphthalen-2-ylmethanesulfonamide?
The InChIKey is SJOGNAIKGLXPLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24N2O2S/c26-24(21-10-3-1-4-11-21)25(22-12-5-2-6-13-22)27-30(28,29)18-19-15-16-20-9-7-8-14-23(20)17-19/h1-17,24-25,27H,18,26H2.
What are the key properties of N-(2-amino-1,2-diphenylethyl)-1-naphthalen-2-ylmethanesulfonamide?
N-(2-amino-1,2-diphenylethyl)-1-naphthalen-2-ylmethanesulfonamide has a molecular weight of 416.55 g/mol, XLogP of 4.70, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-1,2-diphenylethyl)-1-naphthalen-2-ylmethanesulfonamide is sourced from PubChem (CID 59537514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).