N-(2-ethoxyethyl)-5-propyl-4-sulfamoyl-1H-pyrazole-3-carboxamide

C11H20N4O4S — CID 65386835

IUPACN-(2-ethoxyethyl)-5-propyl-4-sulfamoyl-1H-pyrazole-3-carboxamide
SMILESCCCc1[nH]nc(C(=O)NCCOCC)c1S(N)(=O)=O
InChIInChI=1S/C11H20N4O4S/c1-3-5-8-10(20(12,17)18)9(15-14-8)11(16)13-6-7-19-4-2/h3-7H2,1-2H3,(H,13,16)(H,14,15)(H2,12,17,18)
InChIKeyAWRMQEQBAPMDMI-UHFFFAOYSA-N
MW304.37 g/mol
LogP-0.22
Rot. Bonds8

About N-(2-ethoxyethyl)-5-propyl-4-sulfamoyl-1H-pyrazole-3-carboxamide

N-(2-ethoxyethyl)-5-propyl-4-sulfamoyl-1H-pyrazole-3-carboxamide (PubChem CID 65386835) has the molecular formula C11H20N4O4S and a molecular weight of 304.37 g/mol. Its IUPAC name is N-(2-ethoxyethyl)-5-propyl-4-sulfamoyl-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound NameN-(2-ethoxyethyl)-5-propyl-4-sulfamoyl-1H-pyrazole-3-carboxamide
PubChem CID65386835
Molecular FormulaC11H20N4O4S
Molecular Weight304.37 g/mol
Exact Mass304.12
IUPAC NameN-(2-ethoxyethyl)-5-propyl-4-sulfamoyl-1H-pyrazole-3-carboxamide
SMILESCCCc1[nH]nc(C(=O)NCCOCC)c1S(N)(=O)=O
InChIInChI=1S/C11H20N4O4S/c1-3-5-8-10(20(12,17)18)9(15-14-8)11(16)13-6-7-19-4-2/h3-7H2,1-2H3,(H,13,16)(H,14,15)(H2,12,17,18)
InChIKeyAWRMQEQBAPMDMI-UHFFFAOYSA-N
XLogP-0.22
TPSA127.17 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.37
LogP ≤ 5-0.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(2-ethoxyethyl)-5-ethyl-4-sulfamoyl-1H-pyrazole-3-carboxamide
CID 65387027
3-(2-ethoxyethylcarbamoyl)-5-propyl-1H-pyrazole-4-sulfonyl chloride
CID 65371335
4-amino-N-(2-ethoxyethyl)-5-propyl-1H-pyrazole-3-carboxamide
CID 62076097
N-ethyl-5-propyl-4-sulfamoyl-1H-pyrazole-3-carboxamide
CID 65373266
N-methyl-5-propyl-4-sulfamoyl-1H-pyrazole-3-carboxamide
CID 65375401
5-cyclopropyl-N-(2-ethoxyethyl)-4-sulfamoyl-1H-pyrazole-3-carboxamide
CID 65388559
N-(2,2-dimethylpropyl)-5-propyl-4-sulfamoyl-1H-pyrazole-3-carboxamide
CID 65387817
4-amino-N-(3-ethoxypropyl)-5-propyl-1H-pyrazole-3-carboxamide
CID 55034163
4-amino-N-[2-(2-hydroxyethoxy)ethyl]-5-propyl-1H-pyrazole-3-carboxamide
CID 62498759
N-butan-2-yl-5-propyl-4-sulfamoyl-1H-pyrazole-3-carboxamide
CID 65373238
4-amino-N-(2-methoxyethyl)-5-propyl-1H-pyrazole-3-carboxamide
CID 62075273
N-hexan-2-yl-5-propyl-4-sulfamoyl-1H-pyrazole-3-carboxamide
CID 65388449

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyethyl)-5-propyl-4-sulfamoyl-1H-pyrazole-3-carboxamide?
The IUPAC name of N-(2-ethoxyethyl)-5-propyl-4-sulfamoyl-1H-pyrazole-3-carboxamide (CID 65386835) is N-(2-ethoxyethyl)-5-propyl-4-sulfamoyl-1H-pyrazole-3-carboxamide.
What is the SMILES notation for N-(2-ethoxyethyl)-5-propyl-4-sulfamoyl-1H-pyrazole-3-carboxamide?
The canonical SMILES for N-(2-ethoxyethyl)-5-propyl-4-sulfamoyl-1H-pyrazole-3-carboxamide is CCCc1[nH]nc(C(=O)NCCOCC)c1S(N)(=O)=O.
What is the InChIKey of N-(2-ethoxyethyl)-5-propyl-4-sulfamoyl-1H-pyrazole-3-carboxamide?
The InChIKey is AWRMQEQBAPMDMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O4S/c1-3-5-8-10(20(12,17)18)9(15-14-8)11(16)13-6-7-19-4-2/h3-7H2,1-2H3,(H,13,16)(H,14,15)(H2,12,17,18).
What are the key properties of N-(2-ethoxyethyl)-5-propyl-4-sulfamoyl-1H-pyrazole-3-carboxamide?
N-(2-ethoxyethyl)-5-propyl-4-sulfamoyl-1H-pyrazole-3-carboxamide has a molecular weight of 304.37 g/mol, XLogP of -0.22, 8 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyethyl)-5-propyl-4-sulfamoyl-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 65386835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).