N,N,3,5-tetramethyl-1H-pyrazole-4-sulfonamide

C7H13N3O2S — CID 4962643

IUPACN,N,3,5-tetramethyl-1H-pyrazole-4-sulfonamide
SMILESCc1n[nH]c(C)c1S(=O)(=O)N(C)C
InChIInChI=1S/C7H13N3O2S/c1-5-7(6(2)9-8-5)13(11,12)10(3)4/h1-4H3,(H,8,9)
InChIKeyYJCZGTAEFYFJRJ-UHFFFAOYSA-N
MW203.27 g/mol
LogP0.28
Rot. Bonds2

About N,N,3,5-tetramethyl-1H-pyrazole-4-sulfonamide

N,N,3,5-tetramethyl-1H-pyrazole-4-sulfonamide (PubChem CID 4962643) has the molecular formula C7H13N3O2S and a molecular weight of 203.27 g/mol. Its IUPAC name is N,N,3,5-tetramethyl-1H-pyrazole-4-sulfonamide.

Molecular Properties

Compound NameN,N,3,5-tetramethyl-1H-pyrazole-4-sulfonamide
PubChem CID4962643
Molecular FormulaC7H13N3O2S
Molecular Weight203.27 g/mol
Exact Mass203.07
IUPAC NameN,N,3,5-tetramethyl-1H-pyrazole-4-sulfonamide
SMILESCc1n[nH]c(C)c1S(=O)(=O)N(C)C
InChIInChI=1S/C7H13N3O2S/c1-5-7(6(2)9-8-5)13(11,12)10(3)4/h1-4H3,(H,8,9)
InChIKeyYJCZGTAEFYFJRJ-UHFFFAOYSA-N
XLogP0.28
TPSA66.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.27
LogP ≤ 50.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N,3,5-tetramethyl-1H-pyrazole-4-sulfonamide?
The IUPAC name of N,N,3,5-tetramethyl-1H-pyrazole-4-sulfonamide (CID 4962643) is N,N,3,5-tetramethyl-1H-pyrazole-4-sulfonamide.
What is the SMILES notation for N,N,3,5-tetramethyl-1H-pyrazole-4-sulfonamide?
The canonical SMILES for N,N,3,5-tetramethyl-1H-pyrazole-4-sulfonamide is Cc1n[nH]c(C)c1S(=O)(=O)N(C)C.
What is the InChIKey of N,N,3,5-tetramethyl-1H-pyrazole-4-sulfonamide?
The InChIKey is YJCZGTAEFYFJRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N3O2S/c1-5-7(6(2)9-8-5)13(11,12)10(3)4/h1-4H3,(H,8,9).
What are the key properties of N,N,3,5-tetramethyl-1H-pyrazole-4-sulfonamide?
N,N,3,5-tetramethyl-1H-pyrazole-4-sulfonamide has a molecular weight of 203.27 g/mol, XLogP of 0.28, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,3,5-tetramethyl-1H-pyrazole-4-sulfonamide is sourced from PubChem (CID 4962643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).