N,2,2-trimethyl-3-(1H-pyrazol-4-ylsulfonylamino)propanamide

C9H16N4O3S — CID 103824132

IUPACN,2,2-trimethyl-3-(1H-pyrazol-4-ylsulfonylamino)propanamide
SMILESCNC(=O)C(C)(C)CNS(=O)(=O)c1cn[nH]c1
InChIInChI=1S/C9H16N4O3S/c1-9(2,8(14)10-3)6-13-17(15,16)7-4-11-12-5-7/h4-5,13H,6H2,1-3H3,(H,10,14)(H,11,12)
InChIKeyJVWARYFZNREYFN-UHFFFAOYSA-N
MW260.32 g/mol
LogP-0.54
Rot. Bonds5

About N,2,2-trimethyl-3-(1H-pyrazol-4-ylsulfonylamino)propanamide

N,2,2-trimethyl-3-(1H-pyrazol-4-ylsulfonylamino)propanamide (PubChem CID 103824132) has the molecular formula C9H16N4O3S and a molecular weight of 260.32 g/mol. Its IUPAC name is N,2,2-trimethyl-3-(1H-pyrazol-4-ylsulfonylamino)propanamide.

Molecular Properties

Compound NameN,2,2-trimethyl-3-(1H-pyrazol-4-ylsulfonylamino)propanamide
PubChem CID103824132
Molecular FormulaC9H16N4O3S
Molecular Weight260.32 g/mol
Exact Mass260.09
IUPAC NameN,2,2-trimethyl-3-(1H-pyrazol-4-ylsulfonylamino)propanamide
SMILESCNC(=O)C(C)(C)CNS(=O)(=O)c1cn[nH]c1
InChIInChI=1S/C9H16N4O3S/c1-9(2,8(14)10-3)6-13-17(15,16)7-4-11-12-5-7/h4-5,13H,6H2,1-3H3,(H,10,14)(H,11,12)
InChIKeyJVWARYFZNREYFN-UHFFFAOYSA-N
XLogP-0.54
TPSA103.95 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.32
LogP ≤ 5-0.54
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2,3-dihydroxy-2-methylpropyl)-1H-pyrazole-4-sulfonamide
CID 66171038
N-[2-(methanesulfonamido)-2-methylpropyl]-1H-pyrazole-4-sulfonamide
CID 63859195
N-(2,2-difluoro-3-hydroxypropyl)-1H-pyrazole-4-sulfonamide
CID 104858821
N-(5-hydroxy-2,2-dimethylpentyl)-1H-pyrazole-4-sulfonamide
CID 113347933
N-[2-ethyl-2-(hydroxymethyl)butyl]-1H-pyrazole-4-sulfonamide
CID 113334733
3-(1H-imidazol-5-ylsulfonylamino)-N,2,2-trimethylpropanamide
CID 103824162
3-[[4-(bromomethyl)phenyl]sulfonylamino]-N,2,2-trimethylpropanamide
CID 106279745
3-[(2-ethyl-1H-imidazol-5-yl)sulfonylamino]-N,2,2-trimethylpropanamide
CID 106279668
N-tert-butyl-1H-pyrazole-4-sulfonamide
CID 47267365
N-(2-chloropropyl)-1H-pyrazole-4-sulfonamide
CID 65033570
3-[(2-hydrazinyl-4-pyridinyl)sulfonylamino]-N,2,2-trimethylpropanamide
CID 114167516
3-[(3-amino-4-methylphenyl)sulfonylamino]-N,2,2-trimethylpropanamide
CID 106275000

Frequently Asked Questions

What is the IUPAC name of N,2,2-trimethyl-3-(1H-pyrazol-4-ylsulfonylamino)propanamide?
The IUPAC name of N,2,2-trimethyl-3-(1H-pyrazol-4-ylsulfonylamino)propanamide (CID 103824132) is N,2,2-trimethyl-3-(1H-pyrazol-4-ylsulfonylamino)propanamide.
What is the SMILES notation for N,2,2-trimethyl-3-(1H-pyrazol-4-ylsulfonylamino)propanamide?
The canonical SMILES for N,2,2-trimethyl-3-(1H-pyrazol-4-ylsulfonylamino)propanamide is CNC(=O)C(C)(C)CNS(=O)(=O)c1cn[nH]c1.
What is the InChIKey of N,2,2-trimethyl-3-(1H-pyrazol-4-ylsulfonylamino)propanamide?
The InChIKey is JVWARYFZNREYFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N4O3S/c1-9(2,8(14)10-3)6-13-17(15,16)7-4-11-12-5-7/h4-5,13H,6H2,1-3H3,(H,10,14)(H,11,12).
What are the key properties of N,2,2-trimethyl-3-(1H-pyrazol-4-ylsulfonylamino)propanamide?
N,2,2-trimethyl-3-(1H-pyrazol-4-ylsulfonylamino)propanamide has a molecular weight of 260.32 g/mol, XLogP of -0.54, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,2,2-trimethyl-3-(1H-pyrazol-4-ylsulfonylamino)propanamide is sourced from PubChem (CID 103824132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).