2,3-dimethyl-6-[(6-pyrrolidin-1-yl-2-pyridinyl)methoxy]imidazo[1,2-b]pyridazine

C18H21N5O — CID 72706803

IUPAC2,3-dimethyl-6-[(6-pyrrolidin-1-yl-2-pyridinyl)methoxy]imidazo[1,2-b]pyridazine
SMILESCc1nc2ccc(OCc3cccc(N4CCCC4)n3)nn2c1C
InChIInChI=1S/C18H21N5O/c1-13-14(2)23-17(19-13)8-9-18(21-23)24-12-15-6-5-7-16(20-15)22-10-3-4-11-22/h5-9H,3-4,10-12H2,1-2H3
InChIKeyACJRUMLPHWHQHH-UHFFFAOYSA-N
MW323.40 g/mol
LogP2.92
Rot. Bonds4

About 2,3-dimethyl-6-[(6-pyrrolidin-1-yl-2-pyridinyl)methoxy]imidazo[1,2-b]pyridazine

2,3-dimethyl-6-[(6-pyrrolidin-1-yl-2-pyridinyl)methoxy]imidazo[1,2-b]pyridazine (PubChem CID 72706803) has the molecular formula C18H21N5O and a molecular weight of 323.40 g/mol. Its IUPAC name is 2,3-dimethyl-6-[(6-pyrrolidin-1-yl-2-pyridinyl)methoxy]imidazo[1,2-b]pyridazine.

Molecular Properties

Compound Name2,3-dimethyl-6-[(6-pyrrolidin-1-yl-2-pyridinyl)methoxy]imidazo[1,2-b]pyridazine
PubChem CID72706803
Molecular FormulaC18H21N5O
Molecular Weight323.40 g/mol
Exact Mass323.17
IUPAC Name2,3-dimethyl-6-[(6-pyrrolidin-1-yl-2-pyridinyl)methoxy]imidazo[1,2-b]pyridazine
SMILESCc1nc2ccc(OCc3cccc(N4CCCC4)n3)nn2c1C
InChIInChI=1S/C18H21N5O/c1-13-14(2)23-17(19-13)8-9-18(21-23)24-12-15-6-5-7-16(20-15)22-10-3-4-11-22/h5-9H,3-4,10-12H2,1-2H3
InChIKeyACJRUMLPHWHQHH-UHFFFAOYSA-N
XLogP2.92
TPSA55.55 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.40
LogP ≤ 52.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 2,3-dimethyl-6-[(6-pyrrolidin-1-yl-2-pyridinyl)methoxy]imidazo[1,2-b]pyridazine with MolForge

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Related Compounds

US10399985, Example 36
CID 118288233
US10399985, Example 45
CID 122693993
[4-(4-Methoxyphenyl)piperazin-1-yl]-(5-pyrrolidin-1-yltriazolo[4,5-b]pyridin-3-yl)methanone
CID 25051258
2-Ethyl-3-methyl-6-((6-(pyrrolidin-1-yl)pyridin-2-yl)methoxy)imidazo[1,2-b]pyridazine
CID 72706865
2-Methyl-6-((6-(pyrrolidin-1-yl)pyridin-2-yl)methoxy)imidazo[1,2-b]pyridazine
CID 72706867
2,3-Dimethyl-6-((1-methyl-3-(pyrrolidin-1-yl)-1H-1,2,4-triazol-5-yl)methoxy)imidazo[1,2-b]pyridazine
CID 75201285
US10399985, Example 42
CID 118278135
US10399985, Example 35
CID 118278137
US10399985, Example 43
CID 118278179
US10399985, Example 32
CID 118278218
US10399985, Example 34
CID 118278242
US10399985, Example 33
CID 118288234

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-6-[(6-pyrrolidin-1-yl-2-pyridinyl)methoxy]imidazo[1,2-b]pyridazine?
The IUPAC name of 2,3-dimethyl-6-[(6-pyrrolidin-1-yl-2-pyridinyl)methoxy]imidazo[1,2-b]pyridazine (CID 72706803) is 2,3-dimethyl-6-[(6-pyrrolidin-1-yl-2-pyridinyl)methoxy]imidazo[1,2-b]pyridazine.
What is the SMILES notation for 2,3-dimethyl-6-[(6-pyrrolidin-1-yl-2-pyridinyl)methoxy]imidazo[1,2-b]pyridazine?
The canonical SMILES for 2,3-dimethyl-6-[(6-pyrrolidin-1-yl-2-pyridinyl)methoxy]imidazo[1,2-b]pyridazine is Cc1nc2ccc(OCc3cccc(N4CCCC4)n3)nn2c1C.
What is the InChIKey of 2,3-dimethyl-6-[(6-pyrrolidin-1-yl-2-pyridinyl)methoxy]imidazo[1,2-b]pyridazine?
The InChIKey is ACJRUMLPHWHQHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N5O/c1-13-14(2)23-17(19-13)8-9-18(21-23)24-12-15-6-5-7-16(20-15)22-10-3-4-11-22/h5-9H,3-4,10-12H2,1-2H3.
What are the key properties of 2,3-dimethyl-6-[(6-pyrrolidin-1-yl-2-pyridinyl)methoxy]imidazo[1,2-b]pyridazine?
2,3-dimethyl-6-[(6-pyrrolidin-1-yl-2-pyridinyl)methoxy]imidazo[1,2-b]pyridazine has a molecular weight of 323.40 g/mol, XLogP of 2.92, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-6-[(6-pyrrolidin-1-yl-2-pyridinyl)methoxy]imidazo[1,2-b]pyridazine is sourced from PubChem (CID 72706803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).