2-methyl-6-(7H-pyrrolo[2,3-d]pyrimidin-2-yl)imidazo[1,2-b]pyridazine

C13H10N6 — CID 175879601

IUPAC2-methyl-6-(7H-pyrrolo[2,3-d]pyrimidin-2-yl)imidazo[1,2-b]pyridazine
SMILESCc1cn2nc(-c3ncc4cc[nH]c4n3)ccc2n1
InChIInChI=1S/C13H10N6/c1-8-7-19-11(16-8)3-2-10(18-19)13-15-6-9-4-5-14-12(9)17-13/h2-7H,1H3,(H,14,15,17)
InChIKeyHTHFCPFSEAXUFE-UHFFFAOYSA-N
MW250.27 g/mol
LogP1.98
Rot. Bonds1

About 2-methyl-6-(7H-pyrrolo[2,3-d]pyrimidin-2-yl)imidazo[1,2-b]pyridazine

2-methyl-6-(7H-pyrrolo[2,3-d]pyrimidin-2-yl)imidazo[1,2-b]pyridazine (PubChem CID 175879601) has the molecular formula C13H10N6 and a molecular weight of 250.27 g/mol. Its IUPAC name is 2-methyl-6-(7H-pyrrolo[2,3-d]pyrimidin-2-yl)imidazo[1,2-b]pyridazine.

Molecular Properties

Compound Name2-methyl-6-(7H-pyrrolo[2,3-d]pyrimidin-2-yl)imidazo[1,2-b]pyridazine
PubChem CID175879601
Molecular FormulaC13H10N6
Molecular Weight250.27 g/mol
Exact Mass250.10
IUPAC Name2-methyl-6-(7H-pyrrolo[2,3-d]pyrimidin-2-yl)imidazo[1,2-b]pyridazine
SMILESCc1cn2nc(-c3ncc4cc[nH]c4n3)ccc2n1
InChIInChI=1S/C13H10N6/c1-8-7-19-11(16-8)3-2-10(18-19)13-15-6-9-4-5-14-12(9)17-13/h2-7H,1H3,(H,14,15,17)
InChIKeyHTHFCPFSEAXUFE-UHFFFAOYSA-N
XLogP1.98
TPSA71.76 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.27
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-(7H-pyrrolo[2,3-d]pyrimidin-2-yl)imidazo[1,2-b]pyridazine?
The IUPAC name of 2-methyl-6-(7H-pyrrolo[2,3-d]pyrimidin-2-yl)imidazo[1,2-b]pyridazine (CID 175879601) is 2-methyl-6-(7H-pyrrolo[2,3-d]pyrimidin-2-yl)imidazo[1,2-b]pyridazine.
What is the SMILES notation for 2-methyl-6-(7H-pyrrolo[2,3-d]pyrimidin-2-yl)imidazo[1,2-b]pyridazine?
The canonical SMILES for 2-methyl-6-(7H-pyrrolo[2,3-d]pyrimidin-2-yl)imidazo[1,2-b]pyridazine is Cc1cn2nc(-c3ncc4cc[nH]c4n3)ccc2n1.
What is the InChIKey of 2-methyl-6-(7H-pyrrolo[2,3-d]pyrimidin-2-yl)imidazo[1,2-b]pyridazine?
The InChIKey is HTHFCPFSEAXUFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N6/c1-8-7-19-11(16-8)3-2-10(18-19)13-15-6-9-4-5-14-12(9)17-13/h2-7H,1H3,(H,14,15,17).
What are the key properties of 2-methyl-6-(7H-pyrrolo[2,3-d]pyrimidin-2-yl)imidazo[1,2-b]pyridazine?
2-methyl-6-(7H-pyrrolo[2,3-d]pyrimidin-2-yl)imidazo[1,2-b]pyridazine has a molecular weight of 250.27 g/mol, XLogP of 1.98, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-(7H-pyrrolo[2,3-d]pyrimidin-2-yl)imidazo[1,2-b]pyridazine is sourced from PubChem (CID 175879601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).