N-[2-(methanesulfonamido)phenyl]-2-(methylamino)acetamide;hydrochloride

C10H16ClN3O3S — CID 119704021

IUPACN-[2-(methanesulfonamido)phenyl]-2-(methylamino)acetamide;hydrochloride
SMILESCNCC(=O)Nc1ccccc1NS(C)(=O)=O.Cl
InChIInChI=1S/C10H15N3O3S.ClH/c1-11-7-10(14)12-8-5-3-4-6-9(8)13-17(2,15)16;/h3-6,11,13H,7H2,1-2H3,(H,12,14);1H
InChIKeyPHFYJVDMVFIQNK-UHFFFAOYSA-N
MW293.78 g/mol
LogP0.64
Rot. Bonds5

About N-[2-(methanesulfonamido)phenyl]-2-(methylamino)acetamide;hydrochloride

N-[2-(methanesulfonamido)phenyl]-2-(methylamino)acetamide;hydrochloride (PubChem CID 119704021) has the molecular formula C10H16ClN3O3S and a molecular weight of 293.78 g/mol. Its IUPAC name is N-[2-(methanesulfonamido)phenyl]-2-(methylamino)acetamide;hydrochloride.

Molecular Properties

Compound NameN-[2-(methanesulfonamido)phenyl]-2-(methylamino)acetamide;hydrochloride
PubChem CID119704021
Molecular FormulaC10H16ClN3O3S
Molecular Weight293.78 g/mol
Exact Mass293.06
IUPAC NameN-[2-(methanesulfonamido)phenyl]-2-(methylamino)acetamide;hydrochloride
SMILESCNCC(=O)Nc1ccccc1NS(C)(=O)=O.Cl
InChIInChI=1S/C10H15N3O3S.ClH/c1-11-7-10(14)12-8-5-3-4-6-9(8)13-17(2,15)16;/h3-6,11,13H,7H2,1-2H3,(H,12,14);1H
InChIKeyPHFYJVDMVFIQNK-UHFFFAOYSA-N
XLogP0.64
TPSA87.30 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.78
LogP ≤ 50.64
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-(tert-butylamino)-N-[2-(methanesulfonamido)phenyl]acetamide
CID 78923641
2-(cyclopropylamino)-N-[2-(methanesulfonamido)phenyl]acetamide
CID 54924233
4-amino-N-[2-(methanesulfonamido)phenyl]butanamide
CID 43710881
N-[2-(methanesulfonamido)phenyl]-2-methyl-3-(methylamino)propanamide
CID 79195522
5-chloro-N-[2-(methanesulfonamido)phenyl]pentanamide
CID 43700341
6-amino-N-[2-(methanesulfonamido)phenyl]hexanamide
CID 43710875
N-[2-(methanesulfonamido)phenyl]-2-methylpropanamide
CID 47169208
(2R)-2-amino-N-[2-(methanesulfonamido)phenyl]propanamide;hydrochloride
CID 119278967
N-[2-(difluoromethylsulfonyl)phenyl]-2-(methylamino)acetamide
CID 43232974
2-[2-(methanesulfonamido)phenyl]-N-methylacetamide
CID 61061403
2-(methylamino)-N-(2-propan-2-ylsulfanylphenyl)acetamide;hydrochloride
CID 119797995
2-(2-fluorophenoxy)-N-[2-(methanesulfonamido)phenyl]acetamide
CID 35368287

Frequently Asked Questions

What is the IUPAC name of N-[2-(methanesulfonamido)phenyl]-2-(methylamino)acetamide;hydrochloride?
The IUPAC name of N-[2-(methanesulfonamido)phenyl]-2-(methylamino)acetamide;hydrochloride (CID 119704021) is N-[2-(methanesulfonamido)phenyl]-2-(methylamino)acetamide;hydrochloride.
What is the SMILES notation for N-[2-(methanesulfonamido)phenyl]-2-(methylamino)acetamide;hydrochloride?
The canonical SMILES for N-[2-(methanesulfonamido)phenyl]-2-(methylamino)acetamide;hydrochloride is CNCC(=O)Nc1ccccc1NS(C)(=O)=O.Cl.
What is the InChIKey of N-[2-(methanesulfonamido)phenyl]-2-(methylamino)acetamide;hydrochloride?
The InChIKey is PHFYJVDMVFIQNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O3S.ClH/c1-11-7-10(14)12-8-5-3-4-6-9(8)13-17(2,15)16;/h3-6,11,13H,7H2,1-2H3,(H,12,14);1H.
What are the key properties of N-[2-(methanesulfonamido)phenyl]-2-(methylamino)acetamide;hydrochloride?
N-[2-(methanesulfonamido)phenyl]-2-(methylamino)acetamide;hydrochloride has a molecular weight of 293.78 g/mol, XLogP of 0.64, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(methanesulfonamido)phenyl]-2-(methylamino)acetamide;hydrochloride is sourced from PubChem (CID 119704021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).