N-methyl-5-propyl-4-sulfamoyl-1H-pyrazole-3-carboxamide

C8H14N4O3S — CID 65375401

IUPACN-methyl-5-propyl-4-sulfamoyl-1H-pyrazole-3-carboxamide
SMILESCCCc1[nH]nc(C(=O)NC)c1S(N)(=O)=O
InChIInChI=1S/C8H14N4O3S/c1-3-4-5-7(16(9,14)15)6(12-11-5)8(13)10-2/h3-4H2,1-2H3,(H,10,13)(H,11,12)(H2,9,14,15)
InChIKeyLRCFCXCQSGRUFW-UHFFFAOYSA-N
MW246.29 g/mol
LogP-0.63
Rot. Bonds4

About N-methyl-5-propyl-4-sulfamoyl-1H-pyrazole-3-carboxamide

N-methyl-5-propyl-4-sulfamoyl-1H-pyrazole-3-carboxamide (PubChem CID 65375401) has the molecular formula C8H14N4O3S and a molecular weight of 246.29 g/mol. Its IUPAC name is N-methyl-5-propyl-4-sulfamoyl-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound NameN-methyl-5-propyl-4-sulfamoyl-1H-pyrazole-3-carboxamide
PubChem CID65375401
Molecular FormulaC8H14N4O3S
Molecular Weight246.29 g/mol
Exact Mass246.08
IUPAC NameN-methyl-5-propyl-4-sulfamoyl-1H-pyrazole-3-carboxamide
SMILESCCCc1[nH]nc(C(=O)NC)c1S(N)(=O)=O
InChIInChI=1S/C8H14N4O3S/c1-3-4-5-7(16(9,14)15)6(12-11-5)8(13)10-2/h3-4H2,1-2H3,(H,10,13)(H,11,12)(H2,9,14,15)
InChIKeyLRCFCXCQSGRUFW-UHFFFAOYSA-N
XLogP-0.63
TPSA117.94 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.29
LogP ≤ 5-0.63
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-5-propyl-4-sulfamoyl-1H-pyrazole-3-carboxamide
CID 65373266
5-ethyl-N-methyl-4-sulfamoyl-1H-pyrazole-3-carboxamide
CID 65375595
N-(2,2-dimethylpropyl)-5-propyl-4-sulfamoyl-1H-pyrazole-3-carboxamide
CID 65387817
N-butan-2-yl-5-propyl-4-sulfamoyl-1H-pyrazole-3-carboxamide
CID 65373238
N-hexan-2-yl-5-propyl-4-sulfamoyl-1H-pyrazole-3-carboxamide
CID 65388449
N-(2-ethoxyethyl)-5-propyl-4-sulfamoyl-1H-pyrazole-3-carboxamide
CID 65386835
N-(oxolan-2-ylmethyl)-5-propyl-4-sulfamoyl-1H-pyrazole-3-carboxamide
CID 65374367
3,3-dimethylbutyl 5-propyl-4-sulfamoyl-1H-pyrazole-3-carboxylate
CID 66226690
5-ethyl-N-(2-methylsulfonylethyl)-4-sulfamoyl-1H-pyrazole-3-carboxamide
CID 65386269
N-(2,2-dimethylbutyl)-5-ethyl-4-sulfamoyl-1H-pyrazole-3-carboxamide
CID 103465781
3-(butan-2-ylcarbamoyl)-5-propyl-1H-pyrazole-4-sulfonyl chloride
CID 65368759
3-(2,2-dimethylbutylcarbamoyl)-5-propyl-1H-pyrazole-4-sulfonyl chloride
CID 103465535

Frequently Asked Questions

What is the IUPAC name of N-methyl-5-propyl-4-sulfamoyl-1H-pyrazole-3-carboxamide?
The IUPAC name of N-methyl-5-propyl-4-sulfamoyl-1H-pyrazole-3-carboxamide (CID 65375401) is N-methyl-5-propyl-4-sulfamoyl-1H-pyrazole-3-carboxamide.
What is the SMILES notation for N-methyl-5-propyl-4-sulfamoyl-1H-pyrazole-3-carboxamide?
The canonical SMILES for N-methyl-5-propyl-4-sulfamoyl-1H-pyrazole-3-carboxamide is CCCc1[nH]nc(C(=O)NC)c1S(N)(=O)=O.
What is the InChIKey of N-methyl-5-propyl-4-sulfamoyl-1H-pyrazole-3-carboxamide?
The InChIKey is LRCFCXCQSGRUFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N4O3S/c1-3-4-5-7(16(9,14)15)6(12-11-5)8(13)10-2/h3-4H2,1-2H3,(H,10,13)(H,11,12)(H2,9,14,15).
What are the key properties of N-methyl-5-propyl-4-sulfamoyl-1H-pyrazole-3-carboxamide?
N-methyl-5-propyl-4-sulfamoyl-1H-pyrazole-3-carboxamide has a molecular weight of 246.29 g/mol, XLogP of -0.63, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-5-propyl-4-sulfamoyl-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 65375401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).