1-(cyclopropylamino)-N-(6-oxo-1H-pyridazin-3-yl)propane-2-sulfonamide

C10H16N4O3S — CID 106081727

IUPAC1-(cyclopropylamino)-N-(6-oxo-1H-pyridazin-3-yl)propane-2-sulfonamide
SMILESCC(CNC1CC1)S(=O)(=O)Nc1ccc(=O)[nH]n1
InChIInChI=1S/C10H16N4O3S/c1-7(6-11-8-2-3-8)18(16,17)14-9-4-5-10(15)13-12-9/h4-5,7-8,11H,2-3,6H2,1H3,(H,12,14)(H,13,15)
InChIKeyYWHOKMRWDLFOSN-UHFFFAOYSA-N
MW272.33 g/mol
LogP-0.35
Rot. Bonds6

About 1-(cyclopropylamino)-N-(6-oxo-1H-pyridazin-3-yl)propane-2-sulfonamide

1-(cyclopropylamino)-N-(6-oxo-1H-pyridazin-3-yl)propane-2-sulfonamide (PubChem CID 106081727) has the molecular formula C10H16N4O3S and a molecular weight of 272.33 g/mol. Its IUPAC name is 1-(cyclopropylamino)-N-(6-oxo-1H-pyridazin-3-yl)propane-2-sulfonamide.

Molecular Properties

Compound Name1-(cyclopropylamino)-N-(6-oxo-1H-pyridazin-3-yl)propane-2-sulfonamide
PubChem CID106081727
Molecular FormulaC10H16N4O3S
Molecular Weight272.33 g/mol
Exact Mass272.09
IUPAC Name1-(cyclopropylamino)-N-(6-oxo-1H-pyridazin-3-yl)propane-2-sulfonamide
SMILESCC(CNC1CC1)S(=O)(=O)Nc1ccc(=O)[nH]n1
InChIInChI=1S/C10H16N4O3S/c1-7(6-11-8-2-3-8)18(16,17)14-9-4-5-10(15)13-12-9/h4-5,7-8,11H,2-3,6H2,1H3,(H,12,14)(H,13,15)
InChIKeyYWHOKMRWDLFOSN-UHFFFAOYSA-N
XLogP-0.35
TPSA103.95 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.33
LogP ≤ 5-0.35
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropylamino)-N-(6-oxo-1H-pyridazin-3-yl)propane-2-sulfonamide?
The IUPAC name of 1-(cyclopropylamino)-N-(6-oxo-1H-pyridazin-3-yl)propane-2-sulfonamide (CID 106081727) is 1-(cyclopropylamino)-N-(6-oxo-1H-pyridazin-3-yl)propane-2-sulfonamide.
What is the SMILES notation for 1-(cyclopropylamino)-N-(6-oxo-1H-pyridazin-3-yl)propane-2-sulfonamide?
The canonical SMILES for 1-(cyclopropylamino)-N-(6-oxo-1H-pyridazin-3-yl)propane-2-sulfonamide is CC(CNC1CC1)S(=O)(=O)Nc1ccc(=O)[nH]n1.
What is the InChIKey of 1-(cyclopropylamino)-N-(6-oxo-1H-pyridazin-3-yl)propane-2-sulfonamide?
The InChIKey is YWHOKMRWDLFOSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O3S/c1-7(6-11-8-2-3-8)18(16,17)14-9-4-5-10(15)13-12-9/h4-5,7-8,11H,2-3,6H2,1H3,(H,12,14)(H,13,15).
What are the key properties of 1-(cyclopropylamino)-N-(6-oxo-1H-pyridazin-3-yl)propane-2-sulfonamide?
1-(cyclopropylamino)-N-(6-oxo-1H-pyridazin-3-yl)propane-2-sulfonamide has a molecular weight of 272.33 g/mol, XLogP of -0.35, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropylamino)-N-(6-oxo-1H-pyridazin-3-yl)propane-2-sulfonamide is sourced from PubChem (CID 106081727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).