[5-(2,4-dimethylpiperazin-1-yl)sulfonyl-1H-pyrazol-4-yl]methanamine

C10H19N5O2S — CID 114088053

IUPAC[5-(2,4-dimethylpiperazin-1-yl)sulfonyl-1H-pyrazol-4-yl]methanamine
SMILESCC1CN(C)CCN1S(=O)(=O)c1[nH]ncc1CN
InChIInChI=1S/C10H19N5O2S/c1-8-7-14(2)3-4-15(8)18(16,17)10-9(5-11)6-12-13-10/h6,8H,3-5,7,11H2,1-2H3,(H,12,13)
InChIKeyNKWQADZSJCMLIZ-UHFFFAOYSA-N
MW273.36 g/mol
LogP-0.81
Rot. Bonds3

About [5-(2,4-dimethylpiperazin-1-yl)sulfonyl-1H-pyrazol-4-yl]methanamine

[5-(2,4-dimethylpiperazin-1-yl)sulfonyl-1H-pyrazol-4-yl]methanamine (PubChem CID 114088053) has the molecular formula C10H19N5O2S and a molecular weight of 273.36 g/mol. Its IUPAC name is [5-(2,4-dimethylpiperazin-1-yl)sulfonyl-1H-pyrazol-4-yl]methanamine.

Molecular Properties

Compound Name[5-(2,4-dimethylpiperazin-1-yl)sulfonyl-1H-pyrazol-4-yl]methanamine
PubChem CID114088053
Molecular FormulaC10H19N5O2S
Molecular Weight273.36 g/mol
Exact Mass273.13
IUPAC Name[5-(2,4-dimethylpiperazin-1-yl)sulfonyl-1H-pyrazol-4-yl]methanamine
SMILESCC1CN(C)CCN1S(=O)(=O)c1[nH]ncc1CN
InChIInChI=1S/C10H19N5O2S/c1-8-7-14(2)3-4-15(8)18(16,17)10-9(5-11)6-12-13-10/h6,8H,3-5,7,11H2,1-2H3,(H,12,13)
InChIKeyNKWQADZSJCMLIZ-UHFFFAOYSA-N
XLogP-0.81
TPSA95.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.36
LogP ≤ 5-0.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze [5-(2,4-dimethylpiperazin-1-yl)sulfonyl-1H-pyrazol-4-yl]methanamine 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-methyl-1-[(5-methyl-1H-pyrazol-4-yl)sulfonyl]piperazin-2-yl]methanamine
CID 80506146
5-bromo-3-(2,4-dimethylpiperazin-1-yl)sulfonylpyridin-2-amine
CID 103823679
1-[2-(chloromethyl)phenyl]sulfonyl-2,4-dimethylpiperazine
CID 114088037
N-[[5-(3,4,5-trimethylpiperazin-1-yl)sulfonyl-1H-pyrazol-4-yl]methyl]ethanamine
CID 114551758
4-(2,4-dimethylpiperazin-1-yl)sulfonylphenol
CID 114086849
5-[(3R)-3-methylmorpholin-4-yl]sulfonyl-1H-pyrazole-4-carboxylic acid
CID 93350476
4-(aminomethyl)-N-[(2-methylcyclohexyl)methyl]-1H-pyrazole-5-sulfonamide
CID 106018506
ethyl 5-(2-methylpiperazin-1-yl)sulfonyl-1H-pyrazole-4-carboxylate
CID 119969798
5-(2,4-dimethylpiperazin-1-yl)sulfonyl-1,3-dihydroindol-2-one
CID 110707877
4-(aminomethyl)-N-(3-ethyl-1-methylpyrazol-4-yl)-1H-pyrazole-5-sulfonamide
CID 106090355
4-(aminomethyl)-N-(3,3,5,5-tetramethylcyclohexyl)-1H-pyrazole-5-sulfonamide
CID 106077357
4-(aminomethyl)-N-(3-methylbutan-2-yl)-1H-pyrazole-5-sulfonamide
CID 106029958

Frequently Asked Questions

What is the IUPAC name of [5-(2,4-dimethylpiperazin-1-yl)sulfonyl-1H-pyrazol-4-yl]methanamine?
The IUPAC name of [5-(2,4-dimethylpiperazin-1-yl)sulfonyl-1H-pyrazol-4-yl]methanamine (CID 114088053) is [5-(2,4-dimethylpiperazin-1-yl)sulfonyl-1H-pyrazol-4-yl]methanamine.
What is the SMILES notation for [5-(2,4-dimethylpiperazin-1-yl)sulfonyl-1H-pyrazol-4-yl]methanamine?
The canonical SMILES for [5-(2,4-dimethylpiperazin-1-yl)sulfonyl-1H-pyrazol-4-yl]methanamine is CC1CN(C)CCN1S(=O)(=O)c1[nH]ncc1CN.
What is the InChIKey of [5-(2,4-dimethylpiperazin-1-yl)sulfonyl-1H-pyrazol-4-yl]methanamine?
The InChIKey is NKWQADZSJCMLIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N5O2S/c1-8-7-14(2)3-4-15(8)18(16,17)10-9(5-11)6-12-13-10/h6,8H,3-5,7,11H2,1-2H3,(H,12,13).
What are the key properties of [5-(2,4-dimethylpiperazin-1-yl)sulfonyl-1H-pyrazol-4-yl]methanamine?
[5-(2,4-dimethylpiperazin-1-yl)sulfonyl-1H-pyrazol-4-yl]methanamine has a molecular weight of 273.36 g/mol, XLogP of -0.81, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(2,4-dimethylpiperazin-1-yl)sulfonyl-1H-pyrazol-4-yl]methanamine is sourced from PubChem (CID 114088053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).