3-(methanesulfonamido)-1-methylpyrazole-5-carboxamide

C6H10N4O3S — CID 175068156

IUPAC3-(methanesulfonamido)-1-methylpyrazole-5-carboxamide
SMILESCn1nc(NS(C)(=O)=O)cc1C(N)=O
InChIInChI=1S/C6H10N4O3S/c1-10-4(6(7)11)3-5(8-10)9-14(2,12)13/h3H,1-2H3,(H2,7,11)(H,8,9)
InChIKeyUYBFNKVRDMPLTA-UHFFFAOYSA-N
MW218.24 g/mol
LogP-1.11
Rot. Bonds3

About 3-(methanesulfonamido)-1-methylpyrazole-5-carboxamide

3-(methanesulfonamido)-1-methylpyrazole-5-carboxamide (PubChem CID 175068156) has the molecular formula C6H10N4O3S and a molecular weight of 218.24 g/mol. Its IUPAC name is 3-(methanesulfonamido)-1-methylpyrazole-5-carboxamide.

Molecular Properties

Compound Name3-(methanesulfonamido)-1-methylpyrazole-5-carboxamide
PubChem CID175068156
Molecular FormulaC6H10N4O3S
Molecular Weight218.24 g/mol
Exact Mass218.05
IUPAC Name3-(methanesulfonamido)-1-methylpyrazole-5-carboxamide
SMILESCn1nc(NS(C)(=O)=O)cc1C(N)=O
InChIInChI=1S/C6H10N4O3S/c1-10-4(6(7)11)3-5(8-10)9-14(2,12)13/h3H,1-2H3,(H2,7,11)(H,8,9)
InChIKeyUYBFNKVRDMPLTA-UHFFFAOYSA-N
XLogP-1.11
TPSA107.08 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.24
LogP ≤ 5-1.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-(methanesulfonamido)-1-methylpyrazole-5-carboxamide?
The IUPAC name of 3-(methanesulfonamido)-1-methylpyrazole-5-carboxamide (CID 175068156) is 3-(methanesulfonamido)-1-methylpyrazole-5-carboxamide.
What is the SMILES notation for 3-(methanesulfonamido)-1-methylpyrazole-5-carboxamide?
The canonical SMILES for 3-(methanesulfonamido)-1-methylpyrazole-5-carboxamide is Cn1nc(NS(C)(=O)=O)cc1C(N)=O.
What is the InChIKey of 3-(methanesulfonamido)-1-methylpyrazole-5-carboxamide?
The InChIKey is UYBFNKVRDMPLTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N4O3S/c1-10-4(6(7)11)3-5(8-10)9-14(2,12)13/h3H,1-2H3,(H2,7,11)(H,8,9).
What are the key properties of 3-(methanesulfonamido)-1-methylpyrazole-5-carboxamide?
3-(methanesulfonamido)-1-methylpyrazole-5-carboxamide has a molecular weight of 218.24 g/mol, XLogP of -1.11, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methanesulfonamido)-1-methylpyrazole-5-carboxamide is sourced from PubChem (CID 175068156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).