3-pyrazol-1-yl-N-(2-sulfamoylethyl)propanamide

C8H14N4O3S — CID 61130673

IUPAC3-pyrazol-1-yl-N-(2-sulfamoylethyl)propanamide
SMILESNS(=O)(=O)CCNC(=O)CCn1cccn1
InChIInChI=1S/C8H14N4O3S/c9-16(14,15)7-4-10-8(13)2-6-12-5-1-3-11-12/h1,3,5H,2,4,6-7H2,(H,10,13)(H2,9,14,15)
InChIKeyBLQNLOSZNZFHDL-UHFFFAOYSA-N
MW246.29 g/mol
LogP-1.32
Rot. Bonds6

About 3-pyrazol-1-yl-N-(2-sulfamoylethyl)propanamide

3-pyrazol-1-yl-N-(2-sulfamoylethyl)propanamide (PubChem CID 61130673) has the molecular formula C8H14N4O3S and a molecular weight of 246.29 g/mol. Its IUPAC name is 3-pyrazol-1-yl-N-(2-sulfamoylethyl)propanamide.

Molecular Properties

Compound Name3-pyrazol-1-yl-N-(2-sulfamoylethyl)propanamide
PubChem CID61130673
Molecular FormulaC8H14N4O3S
Molecular Weight246.29 g/mol
Exact Mass246.08
IUPAC Name3-pyrazol-1-yl-N-(2-sulfamoylethyl)propanamide
SMILESNS(=O)(=O)CCNC(=O)CCn1cccn1
InChIInChI=1S/C8H14N4O3S/c9-16(14,15)7-4-10-8(13)2-6-12-5-1-3-11-12/h1,3,5H,2,4,6-7H2,(H,10,13)(H2,9,14,15)
InChIKeyBLQNLOSZNZFHDL-UHFFFAOYSA-N
XLogP-1.32
TPSA107.08 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.29
LogP ≤ 5-1.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-pyrazol-1-yl-N-(2-sulfamoylethyl)acetamide
CID 61066533
4-amino-N-(3-pyrazol-1-ylpropyl)butanamide;hydrochloride
CID 119281865
4-oxo-4-(2-pyrazol-1-ylethylamino)butanoic acid
CID 61460027
7-amino-N-(3-pyrazol-1-ylpropyl)heptanamide;hydrochloride
CID 119709906
4-(methylamino)-N-(3-pyrazol-1-ylpropyl)butanamide
CID 115738303
N-[3-(cyclopropylamino)propyl]-3-pyrazol-1-ylpropanamide
CID 43596290
N-(3-amino-2,2-difluoropropyl)-3-pyrazol-1-ylpropanamide
CID 114383611
N-[[4-(aminomethyl)phenyl]methyl]-3-pyrazol-1-ylpropanamide
CID 81089925
4-methylsulfonyl-2-(3-pyrazol-1-ylpropanoylamino)butanoic acid
CID 43102610
N-(2,2-difluoro-3-hydroxypropyl)-3-pyrazol-1-ylpropanamide
CID 104858205
3-(tert-butylamino)-N-(2-pyrazol-1-ylethyl)propanamide
CID 54951704
N-(2-methyl-5-sulfamoylphenyl)-3-pyrazol-1-ylpropanamide
CID 61130308

Frequently Asked Questions

What is the IUPAC name of 3-pyrazol-1-yl-N-(2-sulfamoylethyl)propanamide?
The IUPAC name of 3-pyrazol-1-yl-N-(2-sulfamoylethyl)propanamide (CID 61130673) is 3-pyrazol-1-yl-N-(2-sulfamoylethyl)propanamide.
What is the SMILES notation for 3-pyrazol-1-yl-N-(2-sulfamoylethyl)propanamide?
The canonical SMILES for 3-pyrazol-1-yl-N-(2-sulfamoylethyl)propanamide is NS(=O)(=O)CCNC(=O)CCn1cccn1.
What is the InChIKey of 3-pyrazol-1-yl-N-(2-sulfamoylethyl)propanamide?
The InChIKey is BLQNLOSZNZFHDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N4O3S/c9-16(14,15)7-4-10-8(13)2-6-12-5-1-3-11-12/h1,3,5H,2,4,6-7H2,(H,10,13)(H2,9,14,15).
What are the key properties of 3-pyrazol-1-yl-N-(2-sulfamoylethyl)propanamide?
3-pyrazol-1-yl-N-(2-sulfamoylethyl)propanamide has a molecular weight of 246.29 g/mol, XLogP of -1.32, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-pyrazol-1-yl-N-(2-sulfamoylethyl)propanamide is sourced from PubChem (CID 61130673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).