1,3-dimethyl-5-N-(2-methylpropylsulfamoyl)pyrazole-4,5-diamine

C9H19N5O2S — CID 114814208

IUPAC1,3-dimethyl-5-N-(2-methylpropylsulfamoyl)pyrazole-4,5-diamine
SMILESCc1nn(C)c(NS(=O)(=O)NCC(C)C)c1N
InChIInChI=1S/C9H19N5O2S/c1-6(2)5-11-17(15,16)13-9-8(10)7(3)12-14(9)4/h6,11,13H,5,10H2,1-4H3
InChIKeyRNIFDUVRINNABO-UHFFFAOYSA-N
MW261.35 g/mol
LogP0.21
Rot. Bonds5

About 1,3-dimethyl-5-N-(2-methylpropylsulfamoyl)pyrazole-4,5-diamine

1,3-dimethyl-5-N-(2-methylpropylsulfamoyl)pyrazole-4,5-diamine (PubChem CID 114814208) has the molecular formula C9H19N5O2S and a molecular weight of 261.35 g/mol. Its IUPAC name is 1,3-dimethyl-5-N-(2-methylpropylsulfamoyl)pyrazole-4,5-diamine.

Molecular Properties

Compound Name1,3-dimethyl-5-N-(2-methylpropylsulfamoyl)pyrazole-4,5-diamine
PubChem CID114814208
Molecular FormulaC9H19N5O2S
Molecular Weight261.35 g/mol
Exact Mass261.13
IUPAC Name1,3-dimethyl-5-N-(2-methylpropylsulfamoyl)pyrazole-4,5-diamine
SMILESCc1nn(C)c(NS(=O)(=O)NCC(C)C)c1N
InChIInChI=1S/C9H19N5O2S/c1-6(2)5-11-17(15,16)13-9-8(10)7(3)12-14(9)4/h6,11,13H,5,10H2,1-4H3
InChIKeyRNIFDUVRINNABO-UHFFFAOYSA-N
XLogP0.21
TPSA102.04 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.35
LogP ≤ 50.21
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 1,3-dimethyl-5-N-(2-methylpropylsulfamoyl)pyrazole-4,5-diamine 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

4-amino-1,3-dimethyl-5-(sulfamoylamino)pyrazole
CID 114958732
N-[1-[(4-amino-1,3-dimethylpyrazol-5-yl)amino]-2-methylpropan-2-yl]methanesulfonamide
CID 63863549
1-[(4-amino-1,3-dimethylpyrazol-5-yl)amino]ethanol
CID 70039716
N-(4-amino-1,3-dimethylpyrazol-5-yl)-2-phenylethanesulfonamide
CID 80686025
2-[(4-amino-1,3-dimethylpyrazol-5-yl)amino]propanamide
CID 43554343
3-amino-1,5-dimethyl-N-(2-methylpropyl)pyrazole-4-sulfonamide
CID 105357896
1-methyl-5-(2-methylpropylsulfamoylamino)pyrazole-4-carboximidamide
CID 136994567
5-N-(3,3-dimethylbutan-2-yl)-1,3-dimethylpyrazole-4,5-diamine
CID 104827479
N-(4-amino-1,3-dimethylpyrazol-5-yl)-3-methylpentanamide
CID 114873543
1,3-dimethyl-5-N-(3-pyrrolidin-1-ylpropyl)pyrazole-4,5-diamine
CID 55140744
5-N-(2-ethyl-2-methylsulfanylbutyl)-1,3-dimethylpyrazole-4,5-diamine
CID 114115588
N-(4-amino-1,3-dimethylpyrazol-5-yl)-2-chloro-5-cyanobenzenesulfonamide
CID 80696657

Frequently Asked Questions

What is the IUPAC name of 1,3-dimethyl-5-N-(2-methylpropylsulfamoyl)pyrazole-4,5-diamine?
The IUPAC name of 1,3-dimethyl-5-N-(2-methylpropylsulfamoyl)pyrazole-4,5-diamine (CID 114814208) is 1,3-dimethyl-5-N-(2-methylpropylsulfamoyl)pyrazole-4,5-diamine.
What is the SMILES notation for 1,3-dimethyl-5-N-(2-methylpropylsulfamoyl)pyrazole-4,5-diamine?
The canonical SMILES for 1,3-dimethyl-5-N-(2-methylpropylsulfamoyl)pyrazole-4,5-diamine is Cc1nn(C)c(NS(=O)(=O)NCC(C)C)c1N.
What is the InChIKey of 1,3-dimethyl-5-N-(2-methylpropylsulfamoyl)pyrazole-4,5-diamine?
The InChIKey is RNIFDUVRINNABO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N5O2S/c1-6(2)5-11-17(15,16)13-9-8(10)7(3)12-14(9)4/h6,11,13H,5,10H2,1-4H3.
What are the key properties of 1,3-dimethyl-5-N-(2-methylpropylsulfamoyl)pyrazole-4,5-diamine?
1,3-dimethyl-5-N-(2-methylpropylsulfamoyl)pyrazole-4,5-diamine has a molecular weight of 261.35 g/mol, XLogP of 0.21, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethyl-5-N-(2-methylpropylsulfamoyl)pyrazole-4,5-diamine is sourced from PubChem (CID 114814208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).