N-(3-amino-2-methylpropyl)-N,2-dimethylpyrazole-3-sulfonamide

C9H18N4O2S — CID 104709309

IUPACN-(3-amino-2-methylpropyl)-N,2-dimethylpyrazole-3-sulfonamide
SMILESCC(CN)CN(C)S(=O)(=O)c1ccnn1C
InChIInChI=1S/C9H18N4O2S/c1-8(6-10)7-12(2)16(14,15)9-4-5-11-13(9)3/h4-5,8H,6-7,10H2,1-3H3
InChIKeyITSZMUHHEOOURH-UHFFFAOYSA-N
MW246.34 g/mol
LogP-0.36
Rot. Bonds5

About N-(3-amino-2-methylpropyl)-N,2-dimethylpyrazole-3-sulfonamide

N-(3-amino-2-methylpropyl)-N,2-dimethylpyrazole-3-sulfonamide (PubChem CID 104709309) has the molecular formula C9H18N4O2S and a molecular weight of 246.34 g/mol. Its IUPAC name is N-(3-amino-2-methylpropyl)-N,2-dimethylpyrazole-3-sulfonamide.

Molecular Properties

Compound NameN-(3-amino-2-methylpropyl)-N,2-dimethylpyrazole-3-sulfonamide
PubChem CID104709309
Molecular FormulaC9H18N4O2S
Molecular Weight246.34 g/mol
Exact Mass246.12
IUPAC NameN-(3-amino-2-methylpropyl)-N,2-dimethylpyrazole-3-sulfonamide
SMILESCC(CN)CN(C)S(=O)(=O)c1ccnn1C
InChIInChI=1S/C9H18N4O2S/c1-8(6-10)7-12(2)16(14,15)9-4-5-11-13(9)3/h4-5,8H,6-7,10H2,1-3H3
InChIKeyITSZMUHHEOOURH-UHFFFAOYSA-N
XLogP-0.36
TPSA81.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.34
LogP ≤ 5-0.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(3-amino-2-methylpropyl)-N,2-dimethylpyrazole-3-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-methyl-3-[methyl-(2-methylpyrazol-3-yl)sulfonylamino]propanoic acid
CID 104709586
N-(1-aminopropan-2-yl)-N,2-dimethylpyrazole-3-sulfonamide;hydrochloride
CID 120710548
N-(2-bromo-3-methoxypropyl)-N,2-dimethylpyrazole-3-sulfonamide
CID 104710609
N-[2-(2-aminoethoxy)ethyl]-N,2-dimethylpyrazole-3-sulfonamide
CID 114243749
N-(1-hydroxypropan-2-yl)-N,2-dimethylpyrazole-3-sulfonamide
CID 104710142
N-[(2S)-1-aminopropan-2-yl]-2-methylpyrazole-3-sulfonamide;hydrochloride
CID 120713110
N-[(2-bromophenyl)methyl]-N,2-dimethylpyrazole-3-sulfonamide
CID 104709984
2-[4-(2-methylpyrazol-3-yl)sulfonylpiperazin-1-yl]propan-1-amine
CID 104709342
N-(3-amino-2-methylpropyl)-3,4-difluoro-N-methylbenzenesulfonamide
CID 54992099
methyl 2-[(2-methoxy-2-oxoethyl)-(2-methylpyrazol-3-yl)sulfonylamino]acetate
CID 104710370
2-methyl-N'-(2-methylpyrazol-3-yl)propane-1,3-diamine
CID 103542631
N-[1-(aminomethyl)-3-methylcyclohexyl]-N,2-dimethylpyrazole-3-sulfonamide
CID 104709315

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-2-methylpropyl)-N,2-dimethylpyrazole-3-sulfonamide?
The IUPAC name of N-(3-amino-2-methylpropyl)-N,2-dimethylpyrazole-3-sulfonamide (CID 104709309) is N-(3-amino-2-methylpropyl)-N,2-dimethylpyrazole-3-sulfonamide.
What is the SMILES notation for N-(3-amino-2-methylpropyl)-N,2-dimethylpyrazole-3-sulfonamide?
The canonical SMILES for N-(3-amino-2-methylpropyl)-N,2-dimethylpyrazole-3-sulfonamide is CC(CN)CN(C)S(=O)(=O)c1ccnn1C.
What is the InChIKey of N-(3-amino-2-methylpropyl)-N,2-dimethylpyrazole-3-sulfonamide?
The InChIKey is ITSZMUHHEOOURH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N4O2S/c1-8(6-10)7-12(2)16(14,15)9-4-5-11-13(9)3/h4-5,8H,6-7,10H2,1-3H3.
What are the key properties of N-(3-amino-2-methylpropyl)-N,2-dimethylpyrazole-3-sulfonamide?
N-(3-amino-2-methylpropyl)-N,2-dimethylpyrazole-3-sulfonamide has a molecular weight of 246.34 g/mol, XLogP of -0.36, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-2-methylpropyl)-N,2-dimethylpyrazole-3-sulfonamide is sourced from PubChem (CID 104709309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).