2,7-dipropylpyrrolo[1,2-b]pyridazine

C13H18N2 — CID 12565817

IUPAC2,7-dipropylpyrrolo[1,2-b]pyridazine
SMILESCCCc1ccc2ccc(CCC)n2n1
InChIInChI=1S/C13H18N2/c1-3-5-11-7-8-13-10-9-12(6-4-2)15(13)14-11/h7-10H,3-6H2,1-2H3
InChIKeySJYYVOVQBORQQL-UHFFFAOYSA-N
MW202.30 g/mol
LogP3.24
Rot. Bonds4

About 2,7-dipropylpyrrolo[1,2-b]pyridazine

2,7-dipropylpyrrolo[1,2-b]pyridazine (PubChem CID 12565817) has the molecular formula C13H18N2 and a molecular weight of 202.30 g/mol. Its IUPAC name is 2,7-dipropylpyrrolo[1,2-b]pyridazine.

Molecular Properties

Compound Name2,7-dipropylpyrrolo[1,2-b]pyridazine
PubChem CID12565817
Molecular FormulaC13H18N2
Molecular Weight202.30 g/mol
Exact Mass202.15
IUPAC Name2,7-dipropylpyrrolo[1,2-b]pyridazine
SMILESCCCc1ccc2ccc(CCC)n2n1
InChIInChI=1S/C13H18N2/c1-3-5-11-7-8-13-10-9-12(6-4-2)15(13)14-11/h7-10H,3-6H2,1-2H3
InChIKeySJYYVOVQBORQQL-UHFFFAOYSA-N
XLogP3.24
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 53.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,7-dipropylpyrrolo[1,2-b]pyridazine?
The IUPAC name of 2,7-dipropylpyrrolo[1,2-b]pyridazine (CID 12565817) is 2,7-dipropylpyrrolo[1,2-b]pyridazine.
What is the SMILES notation for 2,7-dipropylpyrrolo[1,2-b]pyridazine?
The canonical SMILES for 2,7-dipropylpyrrolo[1,2-b]pyridazine is CCCc1ccc2ccc(CCC)n2n1.
What is the InChIKey of 2,7-dipropylpyrrolo[1,2-b]pyridazine?
The InChIKey is SJYYVOVQBORQQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2/c1-3-5-11-7-8-13-10-9-12(6-4-2)15(13)14-11/h7-10H,3-6H2,1-2H3.
What are the key properties of 2,7-dipropylpyrrolo[1,2-b]pyridazine?
2,7-dipropylpyrrolo[1,2-b]pyridazine has a molecular weight of 202.30 g/mol, XLogP of 3.24, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,7-dipropylpyrrolo[1,2-b]pyridazine is sourced from PubChem (CID 12565817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).