5-methyl-4-[(5-methyl-1H-pyrazol-4-yl)sulfinyl]-1H-pyrazole

C8H10N4OS — CID 1399641

IUPAC5-methyl-4-[(5-methyl-1H-pyrazol-4-yl)sulfinyl]-1H-pyrazole
SMILESCc1[nH]ncc1S(=O)c1cn[nH]c1C
InChIInChI=1S/C8H10N4OS/c1-5-7(3-9-11-5)14(13)8-4-10-12-6(8)2/h3-4H,1-2H3,(H,9,11)(H,10,12)
InChIKeyWOQYRYXNVSZVCN-UHFFFAOYSA-N
MW210.26 g/mol
LogP0.92
Rot. Bonds2

About 5-methyl-4-[(5-methyl-1H-pyrazol-4-yl)sulfinyl]-1H-pyrazole

5-methyl-4-[(5-methyl-1H-pyrazol-4-yl)sulfinyl]-1H-pyrazole (PubChem CID 1399641) has the molecular formula C8H10N4OS and a molecular weight of 210.26 g/mol. Its IUPAC name is 5-methyl-4-[(5-methyl-1H-pyrazol-4-yl)sulfinyl]-1H-pyrazole.

Molecular Properties

Compound Name5-methyl-4-[(5-methyl-1H-pyrazol-4-yl)sulfinyl]-1H-pyrazole
PubChem CID1399641
Molecular FormulaC8H10N4OS
Molecular Weight210.26 g/mol
Exact Mass210.06
IUPAC Name5-methyl-4-[(5-methyl-1H-pyrazol-4-yl)sulfinyl]-1H-pyrazole
SMILESCc1[nH]ncc1S(=O)c1cn[nH]c1C
InChIInChI=1S/C8H10N4OS/c1-5-7(3-9-11-5)14(13)8-4-10-12-6(8)2/h3-4H,1-2H3,(H,9,11)(H,10,12)
InChIKeyWOQYRYXNVSZVCN-UHFFFAOYSA-N
XLogP0.92
TPSA74.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.26
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 5-methyl-4-[(5-methyl-1H-pyrazol-4-yl)sulfinyl]-1H-pyrazole 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

5,6-dimethyl-1H-pyridazin-4-one
CID 123691408
4-bromo-5-methyl-1H-pyrazole;ethane
CID 168964269
5-methyl-1H-pyrazol-4-amine;dihydrochloride
CID 50998688
5-bromo-1H-pyrazole-4-sulfinic acid
CID 146013861
(NE,R)-2-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methylidene]propane-2-sulfinamide
CID 136622538
N-(5-methyl-1H-pyrazol-4-yl)methanesulfonamide
CID 126995059
1-(5-methyl-1H-pyrazol-4-yl)ethanone;molecular hydrogen
CID 142236647
4-isocyano-5-methyl-1H-pyrazole
CID 20736942
(E)-3-(5-methyl-1H-pyrazol-4-yl)prop-2-enal
CID 135349719
N-[1-(5-methyl-1H-pyrazol-4-yl)ethyl]-3-methylsulfinylpropan-1-amine
CID 115972018
5-methyl-4-prop-1-en-2-yl-1H-pyrazole
CID 70298570
1-(5-methyl-1H-pyrazol-4-yl)ethanamine
CID 43209035

Frequently Asked Questions

What is the IUPAC name of 5-methyl-4-[(5-methyl-1H-pyrazol-4-yl)sulfinyl]-1H-pyrazole?
The IUPAC name of 5-methyl-4-[(5-methyl-1H-pyrazol-4-yl)sulfinyl]-1H-pyrazole (CID 1399641) is 5-methyl-4-[(5-methyl-1H-pyrazol-4-yl)sulfinyl]-1H-pyrazole.
What is the SMILES notation for 5-methyl-4-[(5-methyl-1H-pyrazol-4-yl)sulfinyl]-1H-pyrazole?
The canonical SMILES for 5-methyl-4-[(5-methyl-1H-pyrazol-4-yl)sulfinyl]-1H-pyrazole is Cc1[nH]ncc1S(=O)c1cn[nH]c1C.
What is the InChIKey of 5-methyl-4-[(5-methyl-1H-pyrazol-4-yl)sulfinyl]-1H-pyrazole?
The InChIKey is WOQYRYXNVSZVCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N4OS/c1-5-7(3-9-11-5)14(13)8-4-10-12-6(8)2/h3-4H,1-2H3,(H,9,11)(H,10,12).
What are the key properties of 5-methyl-4-[(5-methyl-1H-pyrazol-4-yl)sulfinyl]-1H-pyrazole?
5-methyl-4-[(5-methyl-1H-pyrazol-4-yl)sulfinyl]-1H-pyrazole has a molecular weight of 210.26 g/mol, XLogP of 0.92, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-4-[(5-methyl-1H-pyrazol-4-yl)sulfinyl]-1H-pyrazole is sourced from PubChem (CID 1399641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).