6-methylsulfanyl-N-[1-(4-pyridin-2-ylpiperazin-1-yl)propan-2-yl]pyridazin-3-amine

C17H24N6S — CID 133307184

IUPAC6-methylsulfanyl-N-[1-(4-pyridin-2-ylpiperazin-1-yl)propan-2-yl]pyridazin-3-amine
SMILESCSc1ccc(NC(C)CN2CCN(c3ccccn3)CC2)nn1
InChIInChI=1S/C17H24N6S/c1-14(19-15-6-7-17(24-2)21-20-15)13-22-9-11-23(12-10-22)16-5-3-4-8-18-16/h3-8,14H,9-13H2,1-2H3,(H,19,20)
InChIKeySTCGAKOEDFZTMY-UHFFFAOYSA-N
MW344.49 g/mol
LogP2.22
Rot. Bonds6

About 6-methylsulfanyl-N-[1-(4-pyridin-2-ylpiperazin-1-yl)propan-2-yl]pyridazin-3-amine

6-methylsulfanyl-N-[1-(4-pyridin-2-ylpiperazin-1-yl)propan-2-yl]pyridazin-3-amine (PubChem CID 133307184) has the molecular formula C17H24N6S and a molecular weight of 344.49 g/mol. Its IUPAC name is 6-methylsulfanyl-N-[1-(4-pyridin-2-ylpiperazin-1-yl)propan-2-yl]pyridazin-3-amine.

Molecular Properties

Compound Name6-methylsulfanyl-N-[1-(4-pyridin-2-ylpiperazin-1-yl)propan-2-yl]pyridazin-3-amine
PubChem CID133307184
Molecular FormulaC17H24N6S
Molecular Weight344.49 g/mol
Exact Mass344.18
IUPAC Name6-methylsulfanyl-N-[1-(4-pyridin-2-ylpiperazin-1-yl)propan-2-yl]pyridazin-3-amine
SMILESCSc1ccc(NC(C)CN2CCN(c3ccccn3)CC2)nn1
InChIInChI=1S/C17H24N6S/c1-14(19-15-6-7-17(24-2)21-20-15)13-22-9-11-23(12-10-22)16-5-3-4-8-18-16/h3-8,14H,9-13H2,1-2H3,(H,19,20)
InChIKeySTCGAKOEDFZTMY-UHFFFAOYSA-N
XLogP2.22
TPSA57.18 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.49
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 6-methylsulfanyl-N-[1-(4-pyridin-2-ylpiperazin-1-yl)propan-2-yl]pyridazin-3-amine with MolForge

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Related Compounds

N-[1-(4-pyridin-2-ylpiperazin-1-yl)propan-2-yl]-5-(trifluoromethyl)pyridin-2-amine
CID 133307275
6-ethyl-2-methyl-N-[1-(4-pyridin-2-ylpiperazin-1-yl)propan-2-yl]pyrimidin-4-amine
CID 133460945
N-ethyl-6-[1-(4-pyridin-2-ylpiperazin-1-yl)propan-2-ylamino]pyridine-3-carboxamide
CID 133307236
1-phenyl-N-[1-(4-pyridin-2-ylpiperazin-1-yl)propan-2-yl]tetrazol-5-amine
CID 133307272
2-methyl-3-(4-pyridin-2-ylpiperazin-1-yl)propan-1-ol
CID 115872740
5-piperidin-1-ylsulfonyl-N-[1-(4-pyridin-2-ylpiperazin-1-yl)propan-2-yl]pyridin-2-amine
CID 133307271
(2S)-1-(4-pyridin-2-ylpiperazin-1-yl)propan-2-amine
CID 22689446
6-[1-(4-pyridin-2-ylpiperazin-1-yl)propan-2-ylamino]-N-(1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide
CID 133339849
3-methyl-4-(4-pyridin-2-ylpiperazin-1-yl)butan-1-amine
CID 80544367
7-fluoro-N-[1-(4-pyridin-2-ylpiperazin-1-yl)propan-2-yl]quinolin-4-amine
CID 133307189
2-fluoro-3-[[1-(4-pyridin-2-ylpiperazin-1-yl)propan-2-ylamino]methyl]phenol
CID 167988142
2-methylsulfonyl-N-[1-(4-pyridin-2-ylpiperazin-1-yl)propan-2-yl]benzamide
CID 86968871

Frequently Asked Questions

What is the IUPAC name of 6-methylsulfanyl-N-[1-(4-pyridin-2-ylpiperazin-1-yl)propan-2-yl]pyridazin-3-amine?
The IUPAC name of 6-methylsulfanyl-N-[1-(4-pyridin-2-ylpiperazin-1-yl)propan-2-yl]pyridazin-3-amine (CID 133307184) is 6-methylsulfanyl-N-[1-(4-pyridin-2-ylpiperazin-1-yl)propan-2-yl]pyridazin-3-amine.
What is the SMILES notation for 6-methylsulfanyl-N-[1-(4-pyridin-2-ylpiperazin-1-yl)propan-2-yl]pyridazin-3-amine?
The canonical SMILES for 6-methylsulfanyl-N-[1-(4-pyridin-2-ylpiperazin-1-yl)propan-2-yl]pyridazin-3-amine is CSc1ccc(NC(C)CN2CCN(c3ccccn3)CC2)nn1.
What is the InChIKey of 6-methylsulfanyl-N-[1-(4-pyridin-2-ylpiperazin-1-yl)propan-2-yl]pyridazin-3-amine?
The InChIKey is STCGAKOEDFZTMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N6S/c1-14(19-15-6-7-17(24-2)21-20-15)13-22-9-11-23(12-10-22)16-5-3-4-8-18-16/h3-8,14H,9-13H2,1-2H3,(H,19,20).
What are the key properties of 6-methylsulfanyl-N-[1-(4-pyridin-2-ylpiperazin-1-yl)propan-2-yl]pyridazin-3-amine?
6-methylsulfanyl-N-[1-(4-pyridin-2-ylpiperazin-1-yl)propan-2-yl]pyridazin-3-amine has a molecular weight of 344.49 g/mol, XLogP of 2.22, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methylsulfanyl-N-[1-(4-pyridin-2-ylpiperazin-1-yl)propan-2-yl]pyridazin-3-amine is sourced from PubChem (CID 133307184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).