N-(1-amino-2-methylpropan-2-yl)-1H-pyrazole-5-sulfonamide

C7H14N4O2S — CID 102690411

IUPACN-(1-amino-2-methylpropan-2-yl)-1H-pyrazole-5-sulfonamide
SMILESCC(C)(CN)NS(=O)(=O)c1ccn[nH]1
InChIInChI=1S/C7H14N4O2S/c1-7(2,5-8)11-14(12,13)6-3-4-9-10-6/h3-4,11H,5,8H2,1-2H3,(H,9,10)
InChIKeyYDNVICADZBXNNH-UHFFFAOYSA-N
MW218.28 g/mol
LogP-0.57
Rot. Bonds4

About N-(1-amino-2-methylpropan-2-yl)-1H-pyrazole-5-sulfonamide

N-(1-amino-2-methylpropan-2-yl)-1H-pyrazole-5-sulfonamide (PubChem CID 102690411) has the molecular formula C7H14N4O2S and a molecular weight of 218.28 g/mol. Its IUPAC name is N-(1-amino-2-methylpropan-2-yl)-1H-pyrazole-5-sulfonamide.

Molecular Properties

Compound NameN-(1-amino-2-methylpropan-2-yl)-1H-pyrazole-5-sulfonamide
PubChem CID102690411
Molecular FormulaC7H14N4O2S
Molecular Weight218.28 g/mol
Exact Mass218.08
IUPAC NameN-(1-amino-2-methylpropan-2-yl)-1H-pyrazole-5-sulfonamide
SMILESCC(C)(CN)NS(=O)(=O)c1ccn[nH]1
InChIInChI=1S/C7H14N4O2S/c1-7(2,5-8)11-14(12,13)6-3-4-9-10-6/h3-4,11H,5,8H2,1-2H3,(H,9,10)
InChIKeyYDNVICADZBXNNH-UHFFFAOYSA-N
XLogP-0.57
TPSA100.87 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.28
LogP ≤ 5-0.57
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-methyl-4-phenylbutan-2-yl)-1H-pyrazole-5-sulfonamide
CID 102693365
N-(2-cyanobutan-2-yl)-1H-pyrazole-5-sulfonamide
CID 102691103
N-(3-cyanopentan-3-yl)-1H-pyrazole-5-sulfonamide
CID 102691104
N'-hydroxy-2,2-dimethyl-3-(1H-pyrazol-5-ylsulfonylamino)propanimidamide
CID 102693887
N-(2-amino-4,4-dimethylpentyl)-1H-pyrazole-5-sulfonamide
CID 107158984
N-(4-amino-3-methylbutan-2-yl)-1H-pyrazole-5-sulfonamide
CID 102694134
N-(4-tert-butylphenyl)-1H-pyrazole-5-sulfonamide
CID 102691460
3-(1H-pyrazol-5-ylsulfonylamino)propanethioamide
CID 102691194
N-(1-amino-2-methylpropan-2-yl)furan-2-sulfonamide
CID 120874897
N-(2-hydroxy-2-methyl-3-methylsulfanylpropyl)-1H-pyrazole-5-sulfonamide
CID 106245543
N-(4-amino-2-ethylbutyl)-1H-pyrazole-5-sulfonamide
CID 102694126
(2R)-3,3-dimethyl-2-(1H-pyrazol-5-ylsulfonylamino)butanoic acid
CID 102690951

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-2-methylpropan-2-yl)-1H-pyrazole-5-sulfonamide?
The IUPAC name of N-(1-amino-2-methylpropan-2-yl)-1H-pyrazole-5-sulfonamide (CID 102690411) is N-(1-amino-2-methylpropan-2-yl)-1H-pyrazole-5-sulfonamide.
What is the SMILES notation for N-(1-amino-2-methylpropan-2-yl)-1H-pyrazole-5-sulfonamide?
The canonical SMILES for N-(1-amino-2-methylpropan-2-yl)-1H-pyrazole-5-sulfonamide is CC(C)(CN)NS(=O)(=O)c1ccn[nH]1.
What is the InChIKey of N-(1-amino-2-methylpropan-2-yl)-1H-pyrazole-5-sulfonamide?
The InChIKey is YDNVICADZBXNNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N4O2S/c1-7(2,5-8)11-14(12,13)6-3-4-9-10-6/h3-4,11H,5,8H2,1-2H3,(H,9,10).
What are the key properties of N-(1-amino-2-methylpropan-2-yl)-1H-pyrazole-5-sulfonamide?
N-(1-amino-2-methylpropan-2-yl)-1H-pyrazole-5-sulfonamide has a molecular weight of 218.28 g/mol, XLogP of -0.57, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-2-methylpropan-2-yl)-1H-pyrazole-5-sulfonamide is sourced from PubChem (CID 102690411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).