2-amino-2-phenyl-N-[2-(propan-2-ylsulfamoyl)ethyl]propanamide;hydrochloride

C14H24ClN3O3S — CID 120590792

IUPAC2-amino-2-phenyl-N-[2-(propan-2-ylsulfamoyl)ethyl]propanamide;hydrochloride
SMILESCC(C)NS(=O)(=O)CCNC(=O)C(C)(N)c1ccccc1.Cl
InChIInChI=1S/C14H23N3O3S.ClH/c1-11(2)17-21(19,20)10-9-16-13(18)14(3,15)12-7-5-4-6-8-12;/h4-8,11,17H,9-10,15H2,1-3H3,(H,16,18);1H
InChIKeyXHJXETYXKKENHA-UHFFFAOYSA-N
MW349.88 g/mol
LogP0.73
Rot. Bonds7

About 2-amino-2-phenyl-N-[2-(propan-2-ylsulfamoyl)ethyl]propanamide;hydrochloride

2-amino-2-phenyl-N-[2-(propan-2-ylsulfamoyl)ethyl]propanamide;hydrochloride (PubChem CID 120590792) has the molecular formula C14H24ClN3O3S and a molecular weight of 349.88 g/mol. Its IUPAC name is 2-amino-2-phenyl-N-[2-(propan-2-ylsulfamoyl)ethyl]propanamide;hydrochloride.

Molecular Properties

Compound Name2-amino-2-phenyl-N-[2-(propan-2-ylsulfamoyl)ethyl]propanamide;hydrochloride
PubChem CID120590792
Molecular FormulaC14H24ClN3O3S
Molecular Weight349.88 g/mol
Exact Mass349.12
IUPAC Name2-amino-2-phenyl-N-[2-(propan-2-ylsulfamoyl)ethyl]propanamide;hydrochloride
SMILESCC(C)NS(=O)(=O)CCNC(=O)C(C)(N)c1ccccc1.Cl
InChIInChI=1S/C14H23N3O3S.ClH/c1-11(2)17-21(19,20)10-9-16-13(18)14(3,15)12-7-5-4-6-8-12;/h4-8,11,17H,9-10,15H2,1-3H3,(H,16,18);1H
InChIKeyXHJXETYXKKENHA-UHFFFAOYSA-N
XLogP0.73
TPSA101.29 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.88
LogP ≤ 50.73
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-(2-ethylsulfonylethyl)-2-phenylpropanamide;hydrochloride
CID 120591623
N-[2-[(2-amino-2-phenylpropanoyl)amino]ethyl]-2,2-dimethylpropanamide
CID 120591033
2-amino-N-[2-(methanesulfonamido)ethyl]-2-phenylpropanamide
CID 55078632
(2S)-2-amino-3-phenyl-N-[2-(propan-2-ylsulfamoyl)ethyl]propanamide;hydrochloride
CID 119309214
2-amino-N-(2-cyclopentylethyl)-2-phenylpropanamide;hydrochloride
CID 120588835
2-amino-2-phenyl-N-(3-pyrrolidin-1-ylpropyl)propanamide;dihydrochloride
CID 120594845
2-amino-N-(3-benzylsulfonylpropyl)-2-phenylpropanamide
CID 120589008
2-amino-N-(2-methoxy-3-methylbutyl)-2-phenylpropanamide;hydrochloride
CID 120593921
2-amino-N-[2-(2-methoxyethoxy)ethyl]-2-phenylpropanamide
CID 55078489
2-amino-2-phenyl-N-[2-(trifluoromethylsulfanyl)ethyl]propanamide;hydrochloride
CID 120588992
2-amino-N-(3-methyl-2-phenylbutyl)-2-phenylpropanamide;hydrochloride
CID 120589227
2-amino-2-phenyl-N-[2-(4-propan-2-ylphenoxy)ethyl]propanamide;hydrochloride
CID 120589403

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-phenyl-N-[2-(propan-2-ylsulfamoyl)ethyl]propanamide;hydrochloride?
The IUPAC name of 2-amino-2-phenyl-N-[2-(propan-2-ylsulfamoyl)ethyl]propanamide;hydrochloride (CID 120590792) is 2-amino-2-phenyl-N-[2-(propan-2-ylsulfamoyl)ethyl]propanamide;hydrochloride.
What is the SMILES notation for 2-amino-2-phenyl-N-[2-(propan-2-ylsulfamoyl)ethyl]propanamide;hydrochloride?
The canonical SMILES for 2-amino-2-phenyl-N-[2-(propan-2-ylsulfamoyl)ethyl]propanamide;hydrochloride is CC(C)NS(=O)(=O)CCNC(=O)C(C)(N)c1ccccc1.Cl.
What is the InChIKey of 2-amino-2-phenyl-N-[2-(propan-2-ylsulfamoyl)ethyl]propanamide;hydrochloride?
The InChIKey is XHJXETYXKKENHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O3S.ClH/c1-11(2)17-21(19,20)10-9-16-13(18)14(3,15)12-7-5-4-6-8-12;/h4-8,11,17H,9-10,15H2,1-3H3,(H,16,18);1H.
What are the key properties of 2-amino-2-phenyl-N-[2-(propan-2-ylsulfamoyl)ethyl]propanamide;hydrochloride?
2-amino-2-phenyl-N-[2-(propan-2-ylsulfamoyl)ethyl]propanamide;hydrochloride has a molecular weight of 349.88 g/mol, XLogP of 0.73, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-phenyl-N-[2-(propan-2-ylsulfamoyl)ethyl]propanamide;hydrochloride is sourced from PubChem (CID 120590792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).