3-[[3-aminopropyl(methyl)sulfamoyl]amino]pyridazine

C8H15N5O2S — CID 116786561

IUPAC3-[[3-aminopropyl(methyl)sulfamoyl]amino]pyridazine
SMILESCN(CCCN)S(=O)(=O)Nc1cccnn1
InChIInChI=1S/C8H15N5O2S/c1-13(7-3-5-9)16(14,15)12-8-4-2-6-10-11-8/h2,4,6H,3,5,7,9H2,1H3,(H,11,12)
InChIKeyQQXIGQDRLAZQTC-UHFFFAOYSA-N
MW245.31 g/mol
LogP-0.59
Rot. Bonds6

About 3-[[3-aminopropyl(methyl)sulfamoyl]amino]pyridazine

3-[[3-aminopropyl(methyl)sulfamoyl]amino]pyridazine (PubChem CID 116786561) has the molecular formula C8H15N5O2S and a molecular weight of 245.31 g/mol. Its IUPAC name is 3-[[3-aminopropyl(methyl)sulfamoyl]amino]pyridazine.

Molecular Properties

Compound Name3-[[3-aminopropyl(methyl)sulfamoyl]amino]pyridazine
PubChem CID116786561
Molecular FormulaC8H15N5O2S
Molecular Weight245.31 g/mol
Exact Mass245.09
IUPAC Name3-[[3-aminopropyl(methyl)sulfamoyl]amino]pyridazine
SMILESCN(CCCN)S(=O)(=O)Nc1cccnn1
InChIInChI=1S/C8H15N5O2S/c1-13(7-3-5-9)16(14,15)12-8-4-2-6-10-11-8/h2,4,6H,3,5,7,9H2,1H3,(H,11,12)
InChIKeyQQXIGQDRLAZQTC-UHFFFAOYSA-N
XLogP-0.59
TPSA101.21 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.31
LogP ≤ 5-0.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-[[3-(cyclopropylamino)propyl-methylsulfamoyl]amino]pyridazine
CID 106084052
3-[[3-aminopropyl(methyl)sulfamoyl]amino]-2-methylpyridine
CID 79042089
2-[[3-aminopropyl(methyl)sulfamoyl]amino]-1,3-dichlorobenzene
CID 114141477
4-[[3-aminopropyl(methyl)sulfamoyl]amino]-3-bromopyridine
CID 106076050
1-[[3-aminopropyl(methyl)sulfamoyl]amino]-4-ethylbenzene
CID 54952240
2-[1-[[3-aminopropyl(methyl)sulfamoyl]amino]ethyl]pyridine
CID 54952613
1-[[3-aminopropyl(methyl)sulfamoyl]amino]-2-methoxybenzene
CID 54952343
1-[[3-aminopropyl(methyl)sulfamoyl]amino]-3-fluoro-2-iodobenzene
CID 114261612
4-[[3-aminopropyl(methyl)sulfamoyl]amino]-2-methoxypyridine
CID 112739513
1-[[3-aminopropyl(methyl)sulfamoyl]amino]-2,3,4-trifluorobenzene
CID 61456312
2-[[3-aminopropyl(methyl)sulfamoyl]amino]-1-bromo-4-iodobenzene
CID 114261617
3-[[3-aminopropyl(methyl)sulfamoyl]amino]quinoline
CID 62782128

Frequently Asked Questions

What is the IUPAC name of 3-[[3-aminopropyl(methyl)sulfamoyl]amino]pyridazine?
The IUPAC name of 3-[[3-aminopropyl(methyl)sulfamoyl]amino]pyridazine (CID 116786561) is 3-[[3-aminopropyl(methyl)sulfamoyl]amino]pyridazine.
What is the SMILES notation for 3-[[3-aminopropyl(methyl)sulfamoyl]amino]pyridazine?
The canonical SMILES for 3-[[3-aminopropyl(methyl)sulfamoyl]amino]pyridazine is CN(CCCN)S(=O)(=O)Nc1cccnn1.
What is the InChIKey of 3-[[3-aminopropyl(methyl)sulfamoyl]amino]pyridazine?
The InChIKey is QQXIGQDRLAZQTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N5O2S/c1-13(7-3-5-9)16(14,15)12-8-4-2-6-10-11-8/h2,4,6H,3,5,7,9H2,1H3,(H,11,12).
What are the key properties of 3-[[3-aminopropyl(methyl)sulfamoyl]amino]pyridazine?
3-[[3-aminopropyl(methyl)sulfamoyl]amino]pyridazine has a molecular weight of 245.31 g/mol, XLogP of -0.59, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[3-aminopropyl(methyl)sulfamoyl]amino]pyridazine is sourced from PubChem (CID 116786561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).