2-[(5-amino-1H-pyrazol-4-yl)sulfonylamino]-2-methylpropanamide

C7H13N5O3S — CID 61211264

IUPAC2-[(5-amino-1H-pyrazol-4-yl)sulfonylamino]-2-methylpropanamide
SMILESCC(C)(NS(=O)(=O)c1cn[nH]c1N)C(N)=O
InChIInChI=1S/C7H13N5O3S/c1-7(2,6(9)13)12-16(14,15)4-3-10-11-5(4)8/h3,12H,1-2H3,(H2,9,13)(H3,8,10,11)
InChIKeyDNQPEIOBVHUCPS-UHFFFAOYSA-N
MW247.28 g/mol
LogP-1.47
Rot. Bonds4

About 2-[(5-amino-1H-pyrazol-4-yl)sulfonylamino]-2-methylpropanamide

2-[(5-amino-1H-pyrazol-4-yl)sulfonylamino]-2-methylpropanamide (PubChem CID 61211264) has the molecular formula C7H13N5O3S and a molecular weight of 247.28 g/mol. Its IUPAC name is 2-[(5-amino-1H-pyrazol-4-yl)sulfonylamino]-2-methylpropanamide.

Molecular Properties

Compound Name2-[(5-amino-1H-pyrazol-4-yl)sulfonylamino]-2-methylpropanamide
PubChem CID61211264
Molecular FormulaC7H13N5O3S
Molecular Weight247.28 g/mol
Exact Mass247.07
IUPAC Name2-[(5-amino-1H-pyrazol-4-yl)sulfonylamino]-2-methylpropanamide
SMILESCC(C)(NS(=O)(=O)c1cn[nH]c1N)C(N)=O
InChIInChI=1S/C7H13N5O3S/c1-7(2,6(9)13)12-16(14,15)4-3-10-11-5(4)8/h3,12H,1-2H3,(H2,9,13)(H3,8,10,11)
InChIKeyDNQPEIOBVHUCPS-UHFFFAOYSA-N
XLogP-1.47
TPSA143.96 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.28
LogP ≤ 5-1.47
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[(5-amino-1H-pyrazol-4-yl)sulfonylamino]-2-methylpropanamide?
The IUPAC name of 2-[(5-amino-1H-pyrazol-4-yl)sulfonylamino]-2-methylpropanamide (CID 61211264) is 2-[(5-amino-1H-pyrazol-4-yl)sulfonylamino]-2-methylpropanamide.
What is the SMILES notation for 2-[(5-amino-1H-pyrazol-4-yl)sulfonylamino]-2-methylpropanamide?
The canonical SMILES for 2-[(5-amino-1H-pyrazol-4-yl)sulfonylamino]-2-methylpropanamide is CC(C)(NS(=O)(=O)c1cn[nH]c1N)C(N)=O.
What is the InChIKey of 2-[(5-amino-1H-pyrazol-4-yl)sulfonylamino]-2-methylpropanamide?
The InChIKey is DNQPEIOBVHUCPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N5O3S/c1-7(2,6(9)13)12-16(14,15)4-3-10-11-5(4)8/h3,12H,1-2H3,(H2,9,13)(H3,8,10,11).
What are the key properties of 2-[(5-amino-1H-pyrazol-4-yl)sulfonylamino]-2-methylpropanamide?
2-[(5-amino-1H-pyrazol-4-yl)sulfonylamino]-2-methylpropanamide has a molecular weight of 247.28 g/mol, XLogP of -1.47, 4 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-amino-1H-pyrazol-4-yl)sulfonylamino]-2-methylpropanamide is sourced from PubChem (CID 61211264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).