2-methyl-3-(methylamino)-N-[2-(propan-2-ylsulfamoyl)ethyl]propanamide;hydrochloride

C10H24ClN3O3S — CID 119758899

IUPAC2-methyl-3-(methylamino)-N-[2-(propan-2-ylsulfamoyl)ethyl]propanamide;hydrochloride
SMILESCNCC(C)C(=O)NCCS(=O)(=O)NC(C)C.Cl
InChIInChI=1S/C10H23N3O3S.ClH/c1-8(2)13-17(15,16)6-5-12-10(14)9(3)7-11-4;/h8-9,11,13H,5-7H2,1-4H3,(H,12,14);1H
InChIKeyRENVLSHYNXSDGQ-UHFFFAOYSA-N
MW301.84 g/mol
LogP-0.29
Rot. Bonds8

About 2-methyl-3-(methylamino)-N-[2-(propan-2-ylsulfamoyl)ethyl]propanamide;hydrochloride

2-methyl-3-(methylamino)-N-[2-(propan-2-ylsulfamoyl)ethyl]propanamide;hydrochloride (PubChem CID 119758899) has the molecular formula C10H24ClN3O3S and a molecular weight of 301.84 g/mol. Its IUPAC name is 2-methyl-3-(methylamino)-N-[2-(propan-2-ylsulfamoyl)ethyl]propanamide;hydrochloride.

Molecular Properties

Compound Name2-methyl-3-(methylamino)-N-[2-(propan-2-ylsulfamoyl)ethyl]propanamide;hydrochloride
PubChem CID119758899
Molecular FormulaC10H24ClN3O3S
Molecular Weight301.84 g/mol
Exact Mass301.12
IUPAC Name2-methyl-3-(methylamino)-N-[2-(propan-2-ylsulfamoyl)ethyl]propanamide;hydrochloride
SMILESCNCC(C)C(=O)NCCS(=O)(=O)NC(C)C.Cl
InChIInChI=1S/C10H23N3O3S.ClH/c1-8(2)13-17(15,16)6-5-12-10(14)9(3)7-11-4;/h8-9,11,13H,5-7H2,1-4H3,(H,12,14);1H
InChIKeyRENVLSHYNXSDGQ-UHFFFAOYSA-N
XLogP-0.29
TPSA87.30 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.84
LogP ≤ 5-0.29
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-[2-(propan-2-ylsulfamoyl)ethyl]pentanamide
CID 119309225
(2S)-2-amino-3-phenyl-N-[2-(propan-2-ylsulfamoyl)ethyl]propanamide;hydrochloride
CID 119309214
N-(5-methoxypentyl)-2-methyl-3-(methylamino)propanamide;hydrochloride
CID 119756762
3-chloro-N-[2-(ethylsulfamoyl)ethyl]-2-methylpropanamide
CID 106335463
2-methyl-3-(methylamino)-N-(2-methylsulfanylethyl)propanamide
CID 79202458
N-(2-methoxy-3-methylbutyl)-2-methyl-3-(methylamino)propanamide;hydrochloride
CID 119813456
2-methyl-3-(methylamino)-N-propan-2-ylpropanamide
CID 79196226
N-(1-cyclopentylethyl)-2-methyl-3-(methylamino)propanamide;hydrochloride
CID 119782455
2-amino-2-phenyl-N-[2-(propan-2-ylsulfamoyl)ethyl]propanamide;hydrochloride
CID 120590792
methyl 3-(propan-2-ylsulfamoyl)propanoate
CID 64590435
N-(2-cyclohexylethyl)-2-methyl-3-(methylamino)propanamide
CID 79195699
methyl 6-[[2-methyl-3-(methylamino)propanoyl]amino]hexanoate
CID 119686226

Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-(methylamino)-N-[2-(propan-2-ylsulfamoyl)ethyl]propanamide;hydrochloride?
The IUPAC name of 2-methyl-3-(methylamino)-N-[2-(propan-2-ylsulfamoyl)ethyl]propanamide;hydrochloride (CID 119758899) is 2-methyl-3-(methylamino)-N-[2-(propan-2-ylsulfamoyl)ethyl]propanamide;hydrochloride.
What is the SMILES notation for 2-methyl-3-(methylamino)-N-[2-(propan-2-ylsulfamoyl)ethyl]propanamide;hydrochloride?
The canonical SMILES for 2-methyl-3-(methylamino)-N-[2-(propan-2-ylsulfamoyl)ethyl]propanamide;hydrochloride is CNCC(C)C(=O)NCCS(=O)(=O)NC(C)C.Cl.
What is the InChIKey of 2-methyl-3-(methylamino)-N-[2-(propan-2-ylsulfamoyl)ethyl]propanamide;hydrochloride?
The InChIKey is RENVLSHYNXSDGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23N3O3S.ClH/c1-8(2)13-17(15,16)6-5-12-10(14)9(3)7-11-4;/h8-9,11,13H,5-7H2,1-4H3,(H,12,14);1H.
What are the key properties of 2-methyl-3-(methylamino)-N-[2-(propan-2-ylsulfamoyl)ethyl]propanamide;hydrochloride?
2-methyl-3-(methylamino)-N-[2-(propan-2-ylsulfamoyl)ethyl]propanamide;hydrochloride has a molecular weight of 301.84 g/mol, XLogP of -0.29, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-(methylamino)-N-[2-(propan-2-ylsulfamoyl)ethyl]propanamide;hydrochloride is sourced from PubChem (CID 119758899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).