N-(1-amino-2-methylpropan-2-yl)-N-ethyl-5-methyl-1H-pyrazole-4-sulfonamide

C10H20N4O2S — CID 62009033

IUPACN-(1-amino-2-methylpropan-2-yl)-N-ethyl-5-methyl-1H-pyrazole-4-sulfonamide
SMILESCCN(C(C)(C)CN)S(=O)(=O)c1cn[nH]c1C
InChIInChI=1S/C10H20N4O2S/c1-5-14(10(3,4)7-11)17(15,16)9-6-12-13-8(9)2/h6H,5,7,11H2,1-4H3,(H,12,13)
InChIKeyIXZUVJAOWIYVKG-UHFFFAOYSA-N
MW260.36 g/mol
LogP0.47
Rot. Bonds5

About N-(1-amino-2-methylpropan-2-yl)-N-ethyl-5-methyl-1H-pyrazole-4-sulfonamide

N-(1-amino-2-methylpropan-2-yl)-N-ethyl-5-methyl-1H-pyrazole-4-sulfonamide (PubChem CID 62009033) has the molecular formula C10H20N4O2S and a molecular weight of 260.36 g/mol. Its IUPAC name is N-(1-amino-2-methylpropan-2-yl)-N-ethyl-5-methyl-1H-pyrazole-4-sulfonamide.

Molecular Properties

Compound NameN-(1-amino-2-methylpropan-2-yl)-N-ethyl-5-methyl-1H-pyrazole-4-sulfonamide
PubChem CID62009033
Molecular FormulaC10H20N4O2S
Molecular Weight260.36 g/mol
Exact Mass260.13
IUPAC NameN-(1-amino-2-methylpropan-2-yl)-N-ethyl-5-methyl-1H-pyrazole-4-sulfonamide
SMILESCCN(C(C)(C)CN)S(=O)(=O)c1cn[nH]c1C
InChIInChI=1S/C10H20N4O2S/c1-5-14(10(3,4)7-11)17(15,16)9-6-12-13-8(9)2/h6H,5,7,11H2,1-4H3,(H,12,13)
InChIKeyIXZUVJAOWIYVKG-UHFFFAOYSA-N
XLogP0.47
TPSA92.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.36
LogP ≤ 50.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(1-amino-2-methylpropan-2-yl)-N-ethyl-5-methyl-1H-pyrazole-4-sulfonamide?
The IUPAC name of N-(1-amino-2-methylpropan-2-yl)-N-ethyl-5-methyl-1H-pyrazole-4-sulfonamide (CID 62009033) is N-(1-amino-2-methylpropan-2-yl)-N-ethyl-5-methyl-1H-pyrazole-4-sulfonamide.
What is the SMILES notation for N-(1-amino-2-methylpropan-2-yl)-N-ethyl-5-methyl-1H-pyrazole-4-sulfonamide?
The canonical SMILES for N-(1-amino-2-methylpropan-2-yl)-N-ethyl-5-methyl-1H-pyrazole-4-sulfonamide is CCN(C(C)(C)CN)S(=O)(=O)c1cn[nH]c1C.
What is the InChIKey of N-(1-amino-2-methylpropan-2-yl)-N-ethyl-5-methyl-1H-pyrazole-4-sulfonamide?
The InChIKey is IXZUVJAOWIYVKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N4O2S/c1-5-14(10(3,4)7-11)17(15,16)9-6-12-13-8(9)2/h6H,5,7,11H2,1-4H3,(H,12,13).
What are the key properties of N-(1-amino-2-methylpropan-2-yl)-N-ethyl-5-methyl-1H-pyrazole-4-sulfonamide?
N-(1-amino-2-methylpropan-2-yl)-N-ethyl-5-methyl-1H-pyrazole-4-sulfonamide has a molecular weight of 260.36 g/mol, XLogP of 0.47, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-2-methylpropan-2-yl)-N-ethyl-5-methyl-1H-pyrazole-4-sulfonamide is sourced from PubChem (CID 62009033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).