4-(3-methyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)morpholine

C10H13N5O — CID 869626

IUPAC4-(3-methyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)morpholine
SMILESCc1nnc2ccc(N3CCOCC3)nn12
InChIInChI=1S/C10H13N5O/c1-8-11-12-9-2-3-10(13-15(8)9)14-4-6-16-7-5-14/h2-3H,4-7H2,1H3
InChIKeyOSNJEIAVBOCVKH-UHFFFAOYSA-N
MW219.25 g/mol
LogP0.27
Rot. Bonds1

About 4-(3-methyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)morpholine

4-(3-methyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)morpholine (PubChem CID 869626) has the molecular formula C10H13N5O and a molecular weight of 219.25 g/mol. Its IUPAC name is 4-(3-methyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)morpholine.

Molecular Properties

Compound Name4-(3-methyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)morpholine
PubChem CID869626
Molecular FormulaC10H13N5O
Molecular Weight219.25 g/mol
Exact Mass219.11
IUPAC Name4-(3-methyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)morpholine
SMILESCc1nnc2ccc(N3CCOCC3)nn12
InChIInChI=1S/C10H13N5O/c1-8-11-12-9-2-3-10(13-15(8)9)14-4-6-16-7-5-14/h2-3H,4-7H2,1H3
InChIKeyOSNJEIAVBOCVKH-UHFFFAOYSA-N
XLogP0.27
TPSA55.55 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.25
LogP ≤ 50.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-(3-methyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)morpholine?
The IUPAC name of 4-(3-methyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)morpholine (CID 869626) is 4-(3-methyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)morpholine.
What is the SMILES notation for 4-(3-methyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)morpholine?
The canonical SMILES for 4-(3-methyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)morpholine is Cc1nnc2ccc(N3CCOCC3)nn12.
What is the InChIKey of 4-(3-methyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)morpholine?
The InChIKey is OSNJEIAVBOCVKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N5O/c1-8-11-12-9-2-3-10(13-15(8)9)14-4-6-16-7-5-14/h2-3H,4-7H2,1H3.
What are the key properties of 4-(3-methyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)morpholine?
4-(3-methyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)morpholine has a molecular weight of 219.25 g/mol, XLogP of 0.27, 1 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-methyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)morpholine is sourced from PubChem (CID 869626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).