(2S)-2-(ethylsulfonylamino)-2-phenyl-N-propan-2-ylacetamide

C13H20N2O3S — CID 110286664

IUPAC(2S)-2-(ethylsulfonylamino)-2-phenyl-N-propan-2-ylacetamide
SMILESCCS(=O)(=O)N[C@H](C(=O)NC(C)C)c1ccccc1
InChIInChI=1S/C13H20N2O3S/c1-4-19(17,18)15-12(13(16)14-10(2)3)11-8-6-5-7-9-11/h5-10,12,15H,4H2,1-3H3,(H,14,16)/t12-/m0/s1
InChIKeyJPSMRWVTOJCVPM-LBPRGKRZSA-N
MW284.38 g/mol
LogP1.19
Rot. Bonds6

About (2S)-2-(ethylsulfonylamino)-2-phenyl-N-propan-2-ylacetamide

(2S)-2-(ethylsulfonylamino)-2-phenyl-N-propan-2-ylacetamide (PubChem CID 110286664) has the molecular formula C13H20N2O3S and a molecular weight of 284.38 g/mol. Its IUPAC name is (2S)-2-(ethylsulfonylamino)-2-phenyl-N-propan-2-ylacetamide.

Molecular Properties

Compound Name(2S)-2-(ethylsulfonylamino)-2-phenyl-N-propan-2-ylacetamide
PubChem CID110286664
Molecular FormulaC13H20N2O3S
Molecular Weight284.38 g/mol
Exact Mass284.12
IUPAC Name(2S)-2-(ethylsulfonylamino)-2-phenyl-N-propan-2-ylacetamide
SMILESCCS(=O)(=O)N[C@H](C(=O)NC(C)C)c1ccccc1
InChIInChI=1S/C13H20N2O3S/c1-4-19(17,18)15-12(13(16)14-10(2)3)11-8-6-5-7-9-11/h5-10,12,15H,4H2,1-3H3,(H,14,16)/t12-/m0/s1
InChIKeyJPSMRWVTOJCVPM-LBPRGKRZSA-N
XLogP1.19
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.38
LogP ≤ 51.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-phenyl-N-propan-2-yl-2-(propylsulfamoylamino)acetamide
CID 110626060
(2S)-2-[(2-chlorophenyl)sulfonylamino]-2-phenyl-N-propan-2-ylacetamide
CID 110286720
2-(ethylsulfonylamino)-2-phenylethanethioamide
CID 61121905
tert-butyl (2R)-2-(ethylsulfonylamino)-2-phenylacetate
CID 81005292
(2S)-2-[(2,5-dimethylphenyl)sulfonylamino]-2-phenyl-N-propan-2-ylacetamide
CID 110286675
(2S)-2-phenyl-N-propan-2-yl-2-[(4-propan-2-yloxyphenyl)sulfonylamino]acetamide
CID 110286716
N-[(1S)-2-methyl-1-phenylpropyl]ethanesulfonamide
CID 94197100
2-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonylamino]-2-phenyl-N-propan-2-ylacetamide
CID 110626063
(2S)-2-(1,3-benzodioxol-5-ylsulfonylamino)-2-phenyl-N-propan-2-ylacetamide
CID 110286688
2-[[1-oxo-1-(propan-2-ylamino)propan-2-yl]amino]-2-phenylacetic acid
CID 62109514
2-[[2-(dimethylamino)-2-phenylacetyl]amino]-2-phenyl-N-propan-2-ylacetamide
CID 110626026
2-(butylsulfonylamino)-2-phenylacetic acid
CID 16775375

Frequently Asked Questions

What is the IUPAC name of (2S)-2-(ethylsulfonylamino)-2-phenyl-N-propan-2-ylacetamide?
The IUPAC name of (2S)-2-(ethylsulfonylamino)-2-phenyl-N-propan-2-ylacetamide (CID 110286664) is (2S)-2-(ethylsulfonylamino)-2-phenyl-N-propan-2-ylacetamide.
What is the SMILES notation for (2S)-2-(ethylsulfonylamino)-2-phenyl-N-propan-2-ylacetamide?
The canonical SMILES for (2S)-2-(ethylsulfonylamino)-2-phenyl-N-propan-2-ylacetamide is CCS(=O)(=O)N[C@H](C(=O)NC(C)C)c1ccccc1.
What is the InChIKey of (2S)-2-(ethylsulfonylamino)-2-phenyl-N-propan-2-ylacetamide?
The InChIKey is JPSMRWVTOJCVPM-LBPRGKRZSA-N. The full InChI is InChI=1S/C13H20N2O3S/c1-4-19(17,18)15-12(13(16)14-10(2)3)11-8-6-5-7-9-11/h5-10,12,15H,4H2,1-3H3,(H,14,16)/t12-/m0/s1.
What are the key properties of (2S)-2-(ethylsulfonylamino)-2-phenyl-N-propan-2-ylacetamide?
(2S)-2-(ethylsulfonylamino)-2-phenyl-N-propan-2-ylacetamide has a molecular weight of 284.38 g/mol, XLogP of 1.19, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(ethylsulfonylamino)-2-phenyl-N-propan-2-ylacetamide is sourced from PubChem (CID 110286664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).