2-[4-(methanesulfonamido)pyrazol-1-yl]acetamide

C6H10N4O3S — CID 61062005

IUPAC2-[4-(methanesulfonamido)pyrazol-1-yl]acetamide
SMILESCS(=O)(=O)Nc1cnn(CC(N)=O)c1
InChIInChI=1S/C6H10N4O3S/c1-14(12,13)9-5-2-8-10(3-5)4-6(7)11/h2-3,9H,4H2,1H3,(H2,7,11)
InChIKeyLLDMSYSOIQPEII-UHFFFAOYSA-N
MW218.24 g/mol
LogP-1.26
Rot. Bonds4

About 2-[4-(methanesulfonamido)pyrazol-1-yl]acetamide

2-[4-(methanesulfonamido)pyrazol-1-yl]acetamide (PubChem CID 61062005) has the molecular formula C6H10N4O3S and a molecular weight of 218.24 g/mol. Its IUPAC name is 2-[4-(methanesulfonamido)pyrazol-1-yl]acetamide.

Molecular Properties

Compound Name2-[4-(methanesulfonamido)pyrazol-1-yl]acetamide
PubChem CID61062005
Molecular FormulaC6H10N4O3S
Molecular Weight218.24 g/mol
Exact Mass218.05
IUPAC Name2-[4-(methanesulfonamido)pyrazol-1-yl]acetamide
SMILESCS(=O)(=O)Nc1cnn(CC(N)=O)c1
InChIInChI=1S/C6H10N4O3S/c1-14(12,13)9-5-2-8-10(3-5)4-6(7)11/h2-3,9H,4H2,1H3,(H2,7,11)
InChIKeyLLDMSYSOIQPEII-UHFFFAOYSA-N
XLogP-1.26
TPSA107.08 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.24
LogP ≤ 5-1.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(methanesulfonamido)pyrazol-1-yl]acetamide?
The IUPAC name of 2-[4-(methanesulfonamido)pyrazol-1-yl]acetamide (CID 61062005) is 2-[4-(methanesulfonamido)pyrazol-1-yl]acetamide.
What is the SMILES notation for 2-[4-(methanesulfonamido)pyrazol-1-yl]acetamide?
The canonical SMILES for 2-[4-(methanesulfonamido)pyrazol-1-yl]acetamide is CS(=O)(=O)Nc1cnn(CC(N)=O)c1.
What is the InChIKey of 2-[4-(methanesulfonamido)pyrazol-1-yl]acetamide?
The InChIKey is LLDMSYSOIQPEII-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N4O3S/c1-14(12,13)9-5-2-8-10(3-5)4-6(7)11/h2-3,9H,4H2,1H3,(H2,7,11).
What are the key properties of 2-[4-(methanesulfonamido)pyrazol-1-yl]acetamide?
2-[4-(methanesulfonamido)pyrazol-1-yl]acetamide has a molecular weight of 218.24 g/mol, XLogP of -1.26, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(methanesulfonamido)pyrazol-1-yl]acetamide is sourced from PubChem (CID 61062005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).