6-(cyclopropylmethoxy)-2-[3-(2-methoxyethoxy)phenyl]-3-methylimidazo[1,2-b]pyridazine

C20H23N3O3 — CID 11382631

IUPAC6-(cyclopropylmethoxy)-2-[3-(2-methoxyethoxy)phenyl]-3-methylimidazo[1,2-b]pyridazine
SMILESCOCCOc1cccc(-c2nc3ccc(OCC4CC4)nn3c2C)c1
InChIInChI=1S/C20H23N3O3/c1-14-20(16-4-3-5-17(12-16)25-11-10-24-2)21-18-8-9-19(22-23(14)18)26-13-15-6-7-15/h3-5,8-9,12,15H,6-7,10-11,13H2,1-2H3
InChIKeyPFFCTCOEBODWCX-UHFFFAOYSA-N
MW353.42 g/mol
LogP3.52
Rot. Bonds8

About 6-(cyclopropylmethoxy)-2-[3-(2-methoxyethoxy)phenyl]-3-methylimidazo[1,2-b]pyridazine

6-(cyclopropylmethoxy)-2-[3-(2-methoxyethoxy)phenyl]-3-methylimidazo[1,2-b]pyridazine (PubChem CID 11382631) has the molecular formula C20H23N3O3 and a molecular weight of 353.42 g/mol. Its IUPAC name is 6-(cyclopropylmethoxy)-2-[3-(2-methoxyethoxy)phenyl]-3-methylimidazo[1,2-b]pyridazine.

Molecular Properties

Compound Name6-(cyclopropylmethoxy)-2-[3-(2-methoxyethoxy)phenyl]-3-methylimidazo[1,2-b]pyridazine
PubChem CID11382631
Molecular FormulaC20H23N3O3
Molecular Weight353.42 g/mol
Exact Mass353.17
IUPAC Name6-(cyclopropylmethoxy)-2-[3-(2-methoxyethoxy)phenyl]-3-methylimidazo[1,2-b]pyridazine
SMILESCOCCOc1cccc(-c2nc3ccc(OCC4CC4)nn3c2C)c1
InChIInChI=1S/C20H23N3O3/c1-14-20(16-4-3-5-17(12-16)25-11-10-24-2)21-18-8-9-19(22-23(14)18)26-13-15-6-7-15/h3-5,8-9,12,15H,6-7,10-11,13H2,1-2H3
InChIKeyPFFCTCOEBODWCX-UHFFFAOYSA-N
XLogP3.52
TPSA57.88 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.42
LogP ≤ 53.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-[3-(2-methoxyethoxy)phenyl]-3-methyl-6-(2-methylpropylsulfanyl)imidazo[1,2-b]pyridazine
CID 11349252
2-[4-(2-methoxyethoxy)phenyl]-3-methyl-6-phenylimidazo[1,2-b]pyridazine
CID 11222115
13-(cyclopropylmethoxy)-5-methoxy-11,12,17-triazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2(7),3,5,12,14,16-heptaene
CID 11232473
6-[4-[(2,3-dimethylimidazo[1,2-b]pyridazin-6-yl)oxymethyl]piperidin-1-yl]pyridine-2-carbonitrile
CID 154582657
6-(oxan-4-ylmethoxy)-3-[3-(trifluoromethoxy)phenyl]imidazo[1,2-b]pyridazine
CID 66598032
6-[[1-(5-chloropyrimidin-2-yl)piperidin-4-yl]methoxy]-2,3-dimethylimidazo[1,2-b]pyridazine
CID 154582669
N-(cyclopropylmethyl)-3-(2-methoxyethoxy)aniline
CID 54803051
3-[4-[(2,3-dimethylimidazo[1,2-b]pyridazin-6-yl)oxymethyl]piperidin-1-yl]pyridine-2-carbonitrile
CID 154580490
1-[2-(2-methoxyethoxy)ethoxy]-3-(2-methylphenyl)benzene
CID 57485291
2-[[6-(cyclopropylmethoxy)-3-pyridinyl]methyl]-1-ethyl-3-[3-(3-methoxypropoxy)phenyl]guanidine;hydroiodide
CID 109460627
5-[3-[(4-methylcyclohexyl)methoxy]phenyl]-2H-triazol-4-amine
CID 170147983
2-(cyclopropylmethylamino)-N-[3-(2-methoxyethoxy)phenyl]acetamide;hydrochloride
CID 119723471

Frequently Asked Questions

What is the IUPAC name of 6-(cyclopropylmethoxy)-2-[3-(2-methoxyethoxy)phenyl]-3-methylimidazo[1,2-b]pyridazine?
The IUPAC name of 6-(cyclopropylmethoxy)-2-[3-(2-methoxyethoxy)phenyl]-3-methylimidazo[1,2-b]pyridazine (CID 11382631) is 6-(cyclopropylmethoxy)-2-[3-(2-methoxyethoxy)phenyl]-3-methylimidazo[1,2-b]pyridazine.
What is the SMILES notation for 6-(cyclopropylmethoxy)-2-[3-(2-methoxyethoxy)phenyl]-3-methylimidazo[1,2-b]pyridazine?
The canonical SMILES for 6-(cyclopropylmethoxy)-2-[3-(2-methoxyethoxy)phenyl]-3-methylimidazo[1,2-b]pyridazine is COCCOc1cccc(-c2nc3ccc(OCC4CC4)nn3c2C)c1.
What is the InChIKey of 6-(cyclopropylmethoxy)-2-[3-(2-methoxyethoxy)phenyl]-3-methylimidazo[1,2-b]pyridazine?
The InChIKey is PFFCTCOEBODWCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O3/c1-14-20(16-4-3-5-17(12-16)25-11-10-24-2)21-18-8-9-19(22-23(14)18)26-13-15-6-7-15/h3-5,8-9,12,15H,6-7,10-11,13H2,1-2H3.
What are the key properties of 6-(cyclopropylmethoxy)-2-[3-(2-methoxyethoxy)phenyl]-3-methylimidazo[1,2-b]pyridazine?
6-(cyclopropylmethoxy)-2-[3-(2-methoxyethoxy)phenyl]-3-methylimidazo[1,2-b]pyridazine has a molecular weight of 353.42 g/mol, XLogP of 3.52, 8 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(cyclopropylmethoxy)-2-[3-(2-methoxyethoxy)phenyl]-3-methylimidazo[1,2-b]pyridazine is sourced from PubChem (CID 11382631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).