N,N-bis(2-methoxyethyl)-1-methyl-3-sulfamoylpyrazole-5-carboxamide

C11H20N4O5S — CID 137499552

IUPACN,N-bis(2-methoxyethyl)-1-methyl-3-sulfamoylpyrazole-5-carboxamide
SMILESCOCCN(CCOC)C(=O)c1cc(S(N)(=O)=O)nn1C
InChIInChI=1S/C11H20N4O5S/c1-14-9(8-10(13-14)21(12,17)18)11(16)15(4-6-19-2)5-7-20-3/h8H,4-7H2,1-3H3,(H2,12,17,18)
InChIKeyQYQHITMBQRGBKI-UHFFFAOYSA-N
MW320.37 g/mol
LogP-1.20
Rot. Bonds8

About N,N-bis(2-methoxyethyl)-1-methyl-3-sulfamoylpyrazole-5-carboxamide

N,N-bis(2-methoxyethyl)-1-methyl-3-sulfamoylpyrazole-5-carboxamide (PubChem CID 137499552) has the molecular formula C11H20N4O5S and a molecular weight of 320.37 g/mol. Its IUPAC name is N,N-bis(2-methoxyethyl)-1-methyl-3-sulfamoylpyrazole-5-carboxamide.

Molecular Properties

Compound NameN,N-bis(2-methoxyethyl)-1-methyl-3-sulfamoylpyrazole-5-carboxamide
PubChem CID137499552
Molecular FormulaC11H20N4O5S
Molecular Weight320.37 g/mol
Exact Mass320.12
IUPAC NameN,N-bis(2-methoxyethyl)-1-methyl-3-sulfamoylpyrazole-5-carboxamide
SMILESCOCCN(CCOC)C(=O)c1cc(S(N)(=O)=O)nn1C
InChIInChI=1S/C11H20N4O5S/c1-14-9(8-10(13-14)21(12,17)18)11(16)15(4-6-19-2)5-7-20-3/h8H,4-7H2,1-3H3,(H2,12,17,18)
InChIKeyQYQHITMBQRGBKI-UHFFFAOYSA-N
XLogP-1.20
TPSA116.75 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.37
LogP ≤ 5-1.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N,N-bis(2-methoxyethyl)-1-methyl-3-sulfamoylpyrazole-5-carboxamide?
The IUPAC name of N,N-bis(2-methoxyethyl)-1-methyl-3-sulfamoylpyrazole-5-carboxamide (CID 137499552) is N,N-bis(2-methoxyethyl)-1-methyl-3-sulfamoylpyrazole-5-carboxamide.
What is the SMILES notation for N,N-bis(2-methoxyethyl)-1-methyl-3-sulfamoylpyrazole-5-carboxamide?
The canonical SMILES for N,N-bis(2-methoxyethyl)-1-methyl-3-sulfamoylpyrazole-5-carboxamide is COCCN(CCOC)C(=O)c1cc(S(N)(=O)=O)nn1C.
What is the InChIKey of N,N-bis(2-methoxyethyl)-1-methyl-3-sulfamoylpyrazole-5-carboxamide?
The InChIKey is QYQHITMBQRGBKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O5S/c1-14-9(8-10(13-14)21(12,17)18)11(16)15(4-6-19-2)5-7-20-3/h8H,4-7H2,1-3H3,(H2,12,17,18).
What are the key properties of N,N-bis(2-methoxyethyl)-1-methyl-3-sulfamoylpyrazole-5-carboxamide?
N,N-bis(2-methoxyethyl)-1-methyl-3-sulfamoylpyrazole-5-carboxamide has a molecular weight of 320.37 g/mol, XLogP of -1.20, 8 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(2-methoxyethyl)-1-methyl-3-sulfamoylpyrazole-5-carboxamide is sourced from PubChem (CID 137499552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).