N-(4,5-dimethyl-1,3-thiazol-2-yl)-1,5-dimethylpyrazole-4-sulfonamide

C10H14N4O2S2 — CID 19582968

IUPACN-(4,5-dimethyl-1,3-thiazol-2-yl)-1,5-dimethylpyrazole-4-sulfonamide
SMILESCc1nc(NS(=O)(=O)c2cnn(C)c2C)sc1C
InChIInChI=1S/C10H14N4O2S2/c1-6-8(3)17-10(12-6)13-18(15,16)9-5-11-14(4)7(9)2/h5H,1-4H3,(H,12,13)
InChIKeyBBBCRVFRLFIGKW-UHFFFAOYSA-N
MW286.38 g/mol
LogP1.60
Rot. Bonds3

About N-(4,5-dimethyl-1,3-thiazol-2-yl)-1,5-dimethylpyrazole-4-sulfonamide

N-(4,5-dimethyl-1,3-thiazol-2-yl)-1,5-dimethylpyrazole-4-sulfonamide (PubChem CID 19582968) has the molecular formula C10H14N4O2S2 and a molecular weight of 286.38 g/mol. Its IUPAC name is N-(4,5-dimethyl-1,3-thiazol-2-yl)-1,5-dimethylpyrazole-4-sulfonamide.

Molecular Properties

Compound NameN-(4,5-dimethyl-1,3-thiazol-2-yl)-1,5-dimethylpyrazole-4-sulfonamide
PubChem CID19582968
Molecular FormulaC10H14N4O2S2
Molecular Weight286.38 g/mol
Exact Mass286.06
IUPAC NameN-(4,5-dimethyl-1,3-thiazol-2-yl)-1,5-dimethylpyrazole-4-sulfonamide
SMILESCc1nc(NS(=O)(=O)c2cnn(C)c2C)sc1C
InChIInChI=1S/C10H14N4O2S2/c1-6-8(3)17-10(12-6)13-18(15,16)9-5-11-14(4)7(9)2/h5H,1-4H3,(H,12,13)
InChIKeyBBBCRVFRLFIGKW-UHFFFAOYSA-N
XLogP1.60
TPSA76.88 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.38
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(4,5-dimethyl-1,3-thiazol-2-yl)-1,5-dimethylpyrazole-4-sulfonamide?
The IUPAC name of N-(4,5-dimethyl-1,3-thiazol-2-yl)-1,5-dimethylpyrazole-4-sulfonamide (CID 19582968) is N-(4,5-dimethyl-1,3-thiazol-2-yl)-1,5-dimethylpyrazole-4-sulfonamide.
What is the SMILES notation for N-(4,5-dimethyl-1,3-thiazol-2-yl)-1,5-dimethylpyrazole-4-sulfonamide?
The canonical SMILES for N-(4,5-dimethyl-1,3-thiazol-2-yl)-1,5-dimethylpyrazole-4-sulfonamide is Cc1nc(NS(=O)(=O)c2cnn(C)c2C)sc1C.
What is the InChIKey of N-(4,5-dimethyl-1,3-thiazol-2-yl)-1,5-dimethylpyrazole-4-sulfonamide?
The InChIKey is BBBCRVFRLFIGKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4O2S2/c1-6-8(3)17-10(12-6)13-18(15,16)9-5-11-14(4)7(9)2/h5H,1-4H3,(H,12,13).
What are the key properties of N-(4,5-dimethyl-1,3-thiazol-2-yl)-1,5-dimethylpyrazole-4-sulfonamide?
N-(4,5-dimethyl-1,3-thiazol-2-yl)-1,5-dimethylpyrazole-4-sulfonamide has a molecular weight of 286.38 g/mol, XLogP of 1.60, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,5-dimethyl-1,3-thiazol-2-yl)-1,5-dimethylpyrazole-4-sulfonamide is sourced from PubChem (CID 19582968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).