3-[(6-cyano-3-pyridinyl)sulfonylamino]-2-hydroxypropanamide

C9H10N4O4S — CID 114153229

IUPAC3-[(6-cyano-3-pyridinyl)sulfonylamino]-2-hydroxypropanamide
SMILESN#Cc1ccc(S(=O)(=O)NCC(O)C(N)=O)cn1
InChIInChI=1S/C9H10N4O4S/c10-3-6-1-2-7(4-12-6)18(16,17)13-5-8(14)9(11)15/h1-2,4,8,13-14H,5H2,(H2,11,15)
InChIKeyTYGJLQYANMIZNA-UHFFFAOYSA-N
MW270.27 g/mol
LogP-1.92
Rot. Bonds5

About 3-[(6-cyano-3-pyridinyl)sulfonylamino]-2-hydroxypropanamide

3-[(6-cyano-3-pyridinyl)sulfonylamino]-2-hydroxypropanamide (PubChem CID 114153229) has the molecular formula C9H10N4O4S and a molecular weight of 270.27 g/mol. Its IUPAC name is 3-[(6-cyano-3-pyridinyl)sulfonylamino]-2-hydroxypropanamide.

Molecular Properties

Compound Name3-[(6-cyano-3-pyridinyl)sulfonylamino]-2-hydroxypropanamide
PubChem CID114153229
Molecular FormulaC9H10N4O4S
Molecular Weight270.27 g/mol
Exact Mass270.04
IUPAC Name3-[(6-cyano-3-pyridinyl)sulfonylamino]-2-hydroxypropanamide
SMILESN#Cc1ccc(S(=O)(=O)NCC(O)C(N)=O)cn1
InChIInChI=1S/C9H10N4O4S/c10-3-6-1-2-7(4-12-6)18(16,17)13-5-8(14)9(11)15/h1-2,4,8,13-14H,5H2,(H2,11,15)
InChIKeyTYGJLQYANMIZNA-UHFFFAOYSA-N
XLogP-1.92
TPSA146.17 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.27
LogP ≤ 5-1.92
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 3-[(6-cyano-3-pyridinyl)sulfonylamino]-2-hydroxypropanamide?
The IUPAC name of 3-[(6-cyano-3-pyridinyl)sulfonylamino]-2-hydroxypropanamide (CID 114153229) is 3-[(6-cyano-3-pyridinyl)sulfonylamino]-2-hydroxypropanamide.
What is the SMILES notation for 3-[(6-cyano-3-pyridinyl)sulfonylamino]-2-hydroxypropanamide?
The canonical SMILES for 3-[(6-cyano-3-pyridinyl)sulfonylamino]-2-hydroxypropanamide is N#Cc1ccc(S(=O)(=O)NCC(O)C(N)=O)cn1.
What is the InChIKey of 3-[(6-cyano-3-pyridinyl)sulfonylamino]-2-hydroxypropanamide?
The InChIKey is TYGJLQYANMIZNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N4O4S/c10-3-6-1-2-7(4-12-6)18(16,17)13-5-8(14)9(11)15/h1-2,4,8,13-14H,5H2,(H2,11,15).
What are the key properties of 3-[(6-cyano-3-pyridinyl)sulfonylamino]-2-hydroxypropanamide?
3-[(6-cyano-3-pyridinyl)sulfonylamino]-2-hydroxypropanamide has a molecular weight of 270.27 g/mol, XLogP of -1.92, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(6-cyano-3-pyridinyl)sulfonylamino]-2-hydroxypropanamide is sourced from PubChem (CID 114153229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).