6-propan-2-yl-3,4-dihydropyrrolo[1,2-b]pyridazine

C10H14N2 — CID 177051723

IUPAC6-propan-2-yl-3,4-dihydropyrrolo[1,2-b]pyridazine
SMILESCC(C)c1cc2n(c1)N=CCC2
InChIInChI=1S/C10H14N2/c1-8(2)9-6-10-4-3-5-11-12(10)7-9/h5-8H,3-4H2,1-2H3
InChIKeyOGRZLYKJHXWKBA-UHFFFAOYSA-N
MW162.24 g/mol
LogP2.39
Rot. Bonds1

About 6-propan-2-yl-3,4-dihydropyrrolo[1,2-b]pyridazine

6-propan-2-yl-3,4-dihydropyrrolo[1,2-b]pyridazine (PubChem CID 177051723) has the molecular formula C10H14N2 and a molecular weight of 162.24 g/mol. Its IUPAC name is 6-propan-2-yl-3,4-dihydropyrrolo[1,2-b]pyridazine.

Molecular Properties

Compound Name6-propan-2-yl-3,4-dihydropyrrolo[1,2-b]pyridazine
PubChem CID177051723
Molecular FormulaC10H14N2
Molecular Weight162.24 g/mol
Exact Mass162.12
IUPAC Name6-propan-2-yl-3,4-dihydropyrrolo[1,2-b]pyridazine
SMILESCC(C)c1cc2n(c1)N=CCC2
InChIInChI=1S/C10H14N2/c1-8(2)9-6-10-4-3-5-11-12(10)7-9/h5-8H,3-4H2,1-2H3
InChIKeyOGRZLYKJHXWKBA-UHFFFAOYSA-N
XLogP2.39
TPSA17.29 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.24
LogP ≤ 52.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-propan-2-yl-3,4-dihydropyrrolo[1,2-b]pyridazine?
The IUPAC name of 6-propan-2-yl-3,4-dihydropyrrolo[1,2-b]pyridazine (CID 177051723) is 6-propan-2-yl-3,4-dihydropyrrolo[1,2-b]pyridazine.
What is the SMILES notation for 6-propan-2-yl-3,4-dihydropyrrolo[1,2-b]pyridazine?
The canonical SMILES for 6-propan-2-yl-3,4-dihydropyrrolo[1,2-b]pyridazine is CC(C)c1cc2n(c1)N=CCC2.
What is the InChIKey of 6-propan-2-yl-3,4-dihydropyrrolo[1,2-b]pyridazine?
The InChIKey is OGRZLYKJHXWKBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2/c1-8(2)9-6-10-4-3-5-11-12(10)7-9/h5-8H,3-4H2,1-2H3.
What are the key properties of 6-propan-2-yl-3,4-dihydropyrrolo[1,2-b]pyridazine?
6-propan-2-yl-3,4-dihydropyrrolo[1,2-b]pyridazine has a molecular weight of 162.24 g/mol, XLogP of 2.39, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-propan-2-yl-3,4-dihydropyrrolo[1,2-b]pyridazine is sourced from PubChem (CID 177051723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).