2-amino-2-methyl-N-[1-[3-(methylsulfamoyl)phenyl]ethyl]pentanamide;hydrochloride

C15H26ClN3O3S — CID 119771247

IUPAC2-amino-2-methyl-N-[1-[3-(methylsulfamoyl)phenyl]ethyl]pentanamide;hydrochloride
SMILESCCCC(C)(N)C(=O)NC(C)c1cccc(S(=O)(=O)NC)c1.Cl
InChIInChI=1S/C15H25N3O3S.ClH/c1-5-9-15(3,16)14(19)18-11(2)12-7-6-8-13(10-12)22(20,21)17-4;/h6-8,10-11,17H,5,9,16H2,1-4H3,(H,18,19);1H
InChIKeyLNYXKTPLDKZEEQ-UHFFFAOYSA-N
MW363.91 g/mol
LogP1.71
Rot. Bonds7

About 2-amino-2-methyl-N-[1-[3-(methylsulfamoyl)phenyl]ethyl]pentanamide;hydrochloride

2-amino-2-methyl-N-[1-[3-(methylsulfamoyl)phenyl]ethyl]pentanamide;hydrochloride (PubChem CID 119771247) has the molecular formula C15H26ClN3O3S and a molecular weight of 363.91 g/mol. Its IUPAC name is 2-amino-2-methyl-N-[1-[3-(methylsulfamoyl)phenyl]ethyl]pentanamide;hydrochloride.

Molecular Properties

Compound Name2-amino-2-methyl-N-[1-[3-(methylsulfamoyl)phenyl]ethyl]pentanamide;hydrochloride
PubChem CID119771247
Molecular FormulaC15H26ClN3O3S
Molecular Weight363.91 g/mol
Exact Mass363.14
IUPAC Name2-amino-2-methyl-N-[1-[3-(methylsulfamoyl)phenyl]ethyl]pentanamide;hydrochloride
SMILESCCCC(C)(N)C(=O)NC(C)c1cccc(S(=O)(=O)NC)c1.Cl
InChIInChI=1S/C15H25N3O3S.ClH/c1-5-9-15(3,16)14(19)18-11(2)12-7-6-8-13(10-12)22(20,21)17-4;/h6-8,10-11,17H,5,9,16H2,1-4H3,(H,18,19);1H
InChIKeyLNYXKTPLDKZEEQ-UHFFFAOYSA-N
XLogP1.71
TPSA101.29 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.91
LogP ≤ 51.71
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-2-methyl-N-[1-[3-(methylsulfamoyl)phenyl]ethyl]propanamide;hydrochloride
CID 119316349
(2R)-2-amino-2-methyl-N-[(1R)-1-phenylethyl]pentanamide
CID 93340243
3-amino-N-[1-[3-(methylsulfamoyl)phenyl]ethyl]butanamide;hydrochloride
CID 119771237
3-amino-N-[1-[3-(methylsulfamoyl)phenyl]ethyl]propanamide
CID 119316352
2-amino-N-[1-(3,4-difluorophenyl)ethyl]-2-methylpentanamide
CID 60847704
2-amino-N-[1-(3,5-dimethylphenyl)ethyl]-2-methylpentanamide;hydrochloride
CID 119778527
3-amino-N-[1-[3-(methylsulfamoyl)phenyl]ethyl]-3-phenylpropanamide;hydrochloride
CID 119951139
N-methyl-3-[1-(propylamino)ethyl]benzenesulfonamide
CID 43506750
2-amino-N-[1-(3-chloro-4-fluorophenyl)ethyl]-2-methylpentanamide
CID 119745685
2-[(2-amino-2-methylpentanoyl)amino]-2-phenylacetic acid
CID 61158432
2-amino-N-[(1S)-1-(3-chlorophenyl)ethyl]-2-ethylbutanamide
CID 81371976
methyl (2S)-2-[[(1S)-1-[3-(methylsulfamoyl)phenyl]ethyl]amino]propanoate
CID 124615830

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-methyl-N-[1-[3-(methylsulfamoyl)phenyl]ethyl]pentanamide;hydrochloride?
The IUPAC name of 2-amino-2-methyl-N-[1-[3-(methylsulfamoyl)phenyl]ethyl]pentanamide;hydrochloride (CID 119771247) is 2-amino-2-methyl-N-[1-[3-(methylsulfamoyl)phenyl]ethyl]pentanamide;hydrochloride.
What is the SMILES notation for 2-amino-2-methyl-N-[1-[3-(methylsulfamoyl)phenyl]ethyl]pentanamide;hydrochloride?
The canonical SMILES for 2-amino-2-methyl-N-[1-[3-(methylsulfamoyl)phenyl]ethyl]pentanamide;hydrochloride is CCCC(C)(N)C(=O)NC(C)c1cccc(S(=O)(=O)NC)c1.Cl.
What is the InChIKey of 2-amino-2-methyl-N-[1-[3-(methylsulfamoyl)phenyl]ethyl]pentanamide;hydrochloride?
The InChIKey is LNYXKTPLDKZEEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O3S.ClH/c1-5-9-15(3,16)14(19)18-11(2)12-7-6-8-13(10-12)22(20,21)17-4;/h6-8,10-11,17H,5,9,16H2,1-4H3,(H,18,19);1H.
What are the key properties of 2-amino-2-methyl-N-[1-[3-(methylsulfamoyl)phenyl]ethyl]pentanamide;hydrochloride?
2-amino-2-methyl-N-[1-[3-(methylsulfamoyl)phenyl]ethyl]pentanamide;hydrochloride has a molecular weight of 363.91 g/mol, XLogP of 1.71, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-methyl-N-[1-[3-(methylsulfamoyl)phenyl]ethyl]pentanamide;hydrochloride is sourced from PubChem (CID 119771247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).