7-(2,2-dimethylpropyl)-4-ethyl-2,3-dihydrofuro[2,3-d]pyridazine

C13H20N2O — CID 90776762

IUPAC7-(2,2-dimethylpropyl)-4-ethyl-2,3-dihydrofuro[2,3-d]pyridazine
SMILESCCc1nnc(CC(C)(C)C)c2c1CCO2
InChIInChI=1S/C13H20N2O/c1-5-10-9-6-7-16-12(9)11(15-14-10)8-13(2,3)4/h5-8H2,1-4H3
InChIKeyZIEVYUYCNYACMX-UHFFFAOYSA-N
MW220.32 g/mol
LogP2.56
Rot. Bonds2

About 7-(2,2-dimethylpropyl)-4-ethyl-2,3-dihydrofuro[2,3-d]pyridazine

7-(2,2-dimethylpropyl)-4-ethyl-2,3-dihydrofuro[2,3-d]pyridazine (PubChem CID 90776762) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is 7-(2,2-dimethylpropyl)-4-ethyl-2,3-dihydrofuro[2,3-d]pyridazine.

Molecular Properties

Compound Name7-(2,2-dimethylpropyl)-4-ethyl-2,3-dihydrofuro[2,3-d]pyridazine
PubChem CID90776762
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC Name7-(2,2-dimethylpropyl)-4-ethyl-2,3-dihydrofuro[2,3-d]pyridazine
SMILESCCc1nnc(CC(C)(C)C)c2c1CCO2
InChIInChI=1S/C13H20N2O/c1-5-10-9-6-7-16-12(9)11(15-14-10)8-13(2,3)4/h5-8H2,1-4H3
InChIKeyZIEVYUYCNYACMX-UHFFFAOYSA-N
XLogP2.56
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 52.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4,7-diethyl-2,3-dihydrofuro[2,3-d]pyridazine
CID 89016017
4-ethyl-7-methyl-2,3-dihydrofuro[2,3-d]pyridazine
CID 91139990
7-(2,2-dimethylpropyl)-4-methyl-2,3-dihydrofuro[2,3-c]pyridine
CID 91168206
8-(2,2-dimethylpropyl)-6-ethyl-4-(2-methylpropyl)-3,7-dihydro-2H-furo[3,2-c]azepine
CID 91297146
4-ethyl-7-methyl-2,3-dihydrofuro[2,3-c]pyridine
CID 91521797
4-(5,7-dichloro-2,3-dihydro-1-benzofuran-4-yl)-5,6-diethylpyrimidin-2-amine
CID 144978818
4-tert-butyl-7-methyl-2,3-dihydrofuro[3,2-c]pyridine
CID 91113567
6-(2,2-dimethylpropyl)-2,3-dihydro-1-benzofuran
CID 59832132
5-(2,2-dimethylpropyl)-6-methyl-3,4-diazatricyclo[6.2.1.02,7]undeca-2(7),3,5-triene
CID 69059729
5-ethyl-7-methoxy-2,3-dihydro-1-benzofuran
CID 170265985
8-(2-hydroxyethyl)-2,3,6,7-tetrahydrofuro[2,3-f][1]benzofuran-4-ol
CID 117317683
8-(2-aminopropyl)-2,3,6,7-tetrahydrofuro[2,3-f][1]benzofuran-4-ol
CID 117342172

Frequently Asked Questions

What is the IUPAC name of 7-(2,2-dimethylpropyl)-4-ethyl-2,3-dihydrofuro[2,3-d]pyridazine?
The IUPAC name of 7-(2,2-dimethylpropyl)-4-ethyl-2,3-dihydrofuro[2,3-d]pyridazine (CID 90776762) is 7-(2,2-dimethylpropyl)-4-ethyl-2,3-dihydrofuro[2,3-d]pyridazine.
What is the SMILES notation for 7-(2,2-dimethylpropyl)-4-ethyl-2,3-dihydrofuro[2,3-d]pyridazine?
The canonical SMILES for 7-(2,2-dimethylpropyl)-4-ethyl-2,3-dihydrofuro[2,3-d]pyridazine is CCc1nnc(CC(C)(C)C)c2c1CCO2.
What is the InChIKey of 7-(2,2-dimethylpropyl)-4-ethyl-2,3-dihydrofuro[2,3-d]pyridazine?
The InChIKey is ZIEVYUYCNYACMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-5-10-9-6-7-16-12(9)11(15-14-10)8-13(2,3)4/h5-8H2,1-4H3.
What are the key properties of 7-(2,2-dimethylpropyl)-4-ethyl-2,3-dihydrofuro[2,3-d]pyridazine?
7-(2,2-dimethylpropyl)-4-ethyl-2,3-dihydrofuro[2,3-d]pyridazine has a molecular weight of 220.32 g/mol, XLogP of 2.56, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(2,2-dimethylpropyl)-4-ethyl-2,3-dihydrofuro[2,3-d]pyridazine is sourced from PubChem (CID 90776762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).