4-(ethoxymethyl)-1-methyl-6-(2-phenylethyl)-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine

C18H25N3O — CID 118739155

IUPAC4-(ethoxymethyl)-1-methyl-6-(2-phenylethyl)-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine
SMILESCCOCC1CN(CCc2ccccc2)Cc2c1cnn2C
InChIInChI=1S/C18H25N3O/c1-3-22-14-16-12-21(10-9-15-7-5-4-6-8-15)13-18-17(16)11-19-20(18)2/h4-8,11,16H,3,9-10,12-14H2,1-2H3
InChIKeyCIPJYCLBUWHYLT-UHFFFAOYSA-N
MW299.42 g/mol
LogP2.60
Rot. Bonds6

About 4-(ethoxymethyl)-1-methyl-6-(2-phenylethyl)-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine

4-(ethoxymethyl)-1-methyl-6-(2-phenylethyl)-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine (PubChem CID 118739155) has the molecular formula C18H25N3O and a molecular weight of 299.42 g/mol. Its IUPAC name is 4-(ethoxymethyl)-1-methyl-6-(2-phenylethyl)-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine.

Molecular Properties

Compound Name4-(ethoxymethyl)-1-methyl-6-(2-phenylethyl)-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine
PubChem CID118739155
Molecular FormulaC18H25N3O
Molecular Weight299.42 g/mol
Exact Mass299.20
IUPAC Name4-(ethoxymethyl)-1-methyl-6-(2-phenylethyl)-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine
SMILESCCOCC1CN(CCc2ccccc2)Cc2c1cnn2C
InChIInChI=1S/C18H25N3O/c1-3-22-14-16-12-21(10-9-15-7-5-4-6-8-15)13-18-17(16)11-19-20(18)2/h4-8,11,16H,3,9-10,12-14H2,1-2H3
InChIKeyCIPJYCLBUWHYLT-UHFFFAOYSA-N
XLogP2.60
TPSA30.29 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.42
LogP ≤ 52.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(ethoxymethyl)-1-methyl-6-(2-phenylethyl)-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine?
The IUPAC name of 4-(ethoxymethyl)-1-methyl-6-(2-phenylethyl)-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine (CID 118739155) is 4-(ethoxymethyl)-1-methyl-6-(2-phenylethyl)-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine.
What is the SMILES notation for 4-(ethoxymethyl)-1-methyl-6-(2-phenylethyl)-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine?
The canonical SMILES for 4-(ethoxymethyl)-1-methyl-6-(2-phenylethyl)-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine is CCOCC1CN(CCc2ccccc2)Cc2c1cnn2C.
What is the InChIKey of 4-(ethoxymethyl)-1-methyl-6-(2-phenylethyl)-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine?
The InChIKey is CIPJYCLBUWHYLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3O/c1-3-22-14-16-12-21(10-9-15-7-5-4-6-8-15)13-18-17(16)11-19-20(18)2/h4-8,11,16H,3,9-10,12-14H2,1-2H3.
What are the key properties of 4-(ethoxymethyl)-1-methyl-6-(2-phenylethyl)-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine?
4-(ethoxymethyl)-1-methyl-6-(2-phenylethyl)-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine has a molecular weight of 299.42 g/mol, XLogP of 2.60, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(ethoxymethyl)-1-methyl-6-(2-phenylethyl)-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine is sourced from PubChem (CID 118739155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).