(2S)-2-(benzenesulfonamido)-N-(2-phenylethyl)propanamide

C17H20N2O3S — CID 41330945

IUPAC(2S)-2-(benzenesulfonamido)-N-(2-phenylethyl)propanamide
SMILESC[C@H](NS(=O)(=O)c1ccccc1)C(=O)NCCc1ccccc1
InChIInChI=1S/C17H20N2O3S/c1-14(19-23(21,22)16-10-6-3-7-11-16)17(20)18-13-12-15-8-4-2-5-9-15/h2-11,14,19H,12-13H2,1H3,(H,18,20)/t14-/m0/s1
InChIKeySAAVEHAWQVRABL-AWEZNQCLSA-N
MW332.43 g/mol
LogP1.71
Rot. Bonds7

About (2S)-2-(benzenesulfonamido)-N-(2-phenylethyl)propanamide

(2S)-2-(benzenesulfonamido)-N-(2-phenylethyl)propanamide (PubChem CID 41330945) has the molecular formula C17H20N2O3S and a molecular weight of 332.43 g/mol. Its IUPAC name is (2S)-2-(benzenesulfonamido)-N-(2-phenylethyl)propanamide.

Molecular Properties

Compound Name(2S)-2-(benzenesulfonamido)-N-(2-phenylethyl)propanamide
PubChem CID41330945
Molecular FormulaC17H20N2O3S
Molecular Weight332.43 g/mol
Exact Mass332.12
IUPAC Name(2S)-2-(benzenesulfonamido)-N-(2-phenylethyl)propanamide
SMILESC[C@H](NS(=O)(=O)c1ccccc1)C(=O)NCCc1ccccc1
InChIInChI=1S/C17H20N2O3S/c1-14(19-23(21,22)16-10-6-3-7-11-16)17(20)18-13-12-15-8-4-2-5-9-15/h2-11,14,19H,12-13H2,1H3,(H,18,20)/t14-/m0/s1
InChIKeySAAVEHAWQVRABL-AWEZNQCLSA-N
XLogP1.71
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.43
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-[(4-methoxyphenyl)sulfonylamino]-N-(2-phenylethyl)propanamide
CID 40640573
N-(2-phenylethyl)-2-[(2,4,6-trimethylphenyl)sulfonylamino]propanamide
CID 43890199
Se-phenyl 3-[2-(benzenesulfonamido)propanoylamino]propaneselenoate
CID 11408004
2,2-diphenyl-N-[2-[4-(propan-2-ylsulfamoyl)phenyl]ethyl]acetamide
CID 30125446
(2S)-N-benzyl-2-[(4-tert-butylphenyl)sulfonylamino]propanamide
CID 9041047
(2S)-2-(benzenesulfonamido)-N-phenylpropanamide
CID 41330853
2-(benzenesulfonamido)-N-propan-2-ylpropanamide
CID 3279426
(2S)-2-(benzenesulfonamido)-N-[[3-(dimethylamino)phenyl]methyl]propanamide
CID 60608615
[2-[2-(4-methoxyphenyl)ethylamino]-2-oxoethyl] (2S)-2-(benzenesulfonamido)propanoate
CID 55927410
(2S)-2-acetamido-N-(2-phenylethyl)propanamide
CID 51647688
2-[[4-(2-aminoethyl)phenyl]sulfonylamino]-N-propylpropanamide
CID 79185012
2-[(4-fluorophenyl)sulfonylamino]-N-(2-phenylethyl)butanamide
CID 110496326

Frequently Asked Questions

What is the IUPAC name of (2S)-2-(benzenesulfonamido)-N-(2-phenylethyl)propanamide?
The IUPAC name of (2S)-2-(benzenesulfonamido)-N-(2-phenylethyl)propanamide (CID 41330945) is (2S)-2-(benzenesulfonamido)-N-(2-phenylethyl)propanamide.
What is the SMILES notation for (2S)-2-(benzenesulfonamido)-N-(2-phenylethyl)propanamide?
The canonical SMILES for (2S)-2-(benzenesulfonamido)-N-(2-phenylethyl)propanamide is C[C@H](NS(=O)(=O)c1ccccc1)C(=O)NCCc1ccccc1.
What is the InChIKey of (2S)-2-(benzenesulfonamido)-N-(2-phenylethyl)propanamide?
The InChIKey is SAAVEHAWQVRABL-AWEZNQCLSA-N. The full InChI is InChI=1S/C17H20N2O3S/c1-14(19-23(21,22)16-10-6-3-7-11-16)17(20)18-13-12-15-8-4-2-5-9-15/h2-11,14,19H,12-13H2,1H3,(H,18,20)/t14-/m0/s1.
What are the key properties of (2S)-2-(benzenesulfonamido)-N-(2-phenylethyl)propanamide?
(2S)-2-(benzenesulfonamido)-N-(2-phenylethyl)propanamide has a molecular weight of 332.43 g/mol, XLogP of 1.71, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(benzenesulfonamido)-N-(2-phenylethyl)propanamide is sourced from PubChem (CID 41330945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).