8-propyl-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-5-one

C10H15N3O — CID 59751960

IUPAC8-propyl-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-5-one
SMILESCCCc1n[nH]c(=O)c2c1NCCC2
InChIInChI=1S/C10H15N3O/c1-2-4-8-9-7(5-3-6-11-9)10(14)13-12-8/h11H,2-6H2,1H3,(H,13,14)
InChIKeyAOGCJRGICKFVRK-UHFFFAOYSA-N
MW193.25 g/mol
LogP1.08
Rot. Bonds2

About 8-propyl-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-5-one

8-propyl-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-5-one (PubChem CID 59751960) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is 8-propyl-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-5-one.

Molecular Properties

Compound Name8-propyl-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-5-one
PubChem CID59751960
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC Name8-propyl-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-5-one
SMILESCCCc1n[nH]c(=O)c2c1NCCC2
InChIInChI=1S/C10H15N3O/c1-2-4-8-9-7(5-3-6-11-9)10(14)13-12-8/h11H,2-6H2,1H3,(H,13,14)
InChIKeyAOGCJRGICKFVRK-UHFFFAOYSA-N
XLogP1.08
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 8-propyl-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-5-one?
The IUPAC name of 8-propyl-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-5-one (CID 59751960) is 8-propyl-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-5-one.
What is the SMILES notation for 8-propyl-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-5-one?
The canonical SMILES for 8-propyl-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-5-one is CCCc1n[nH]c(=O)c2c1NCCC2.
What is the InChIKey of 8-propyl-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-5-one?
The InChIKey is AOGCJRGICKFVRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O/c1-2-4-8-9-7(5-3-6-11-9)10(14)13-12-8/h11H,2-6H2,1H3,(H,13,14).
What are the key properties of 8-propyl-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-5-one?
8-propyl-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-5-one has a molecular weight of 193.25 g/mol, XLogP of 1.08, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-propyl-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-5-one is sourced from PubChem (CID 59751960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).