6-(2-methoxyethyl)-3-methyl-2,4,5,7-tetrahydropyrazolo[3,4-c]pyridine

C10H17N3O — CID 118491658

IUPAC6-(2-methoxyethyl)-3-methyl-2,4,5,7-tetrahydropyrazolo[3,4-c]pyridine
SMILESCOCCN1CCc2c(n[nH]c2C)C1
InChIInChI=1S/C10H17N3O/c1-8-9-3-4-13(5-6-14-2)7-10(9)12-11-8/h3-7H2,1-2H3,(H,11,12)
InChIKeyOKMYISDQIFQUCK-UHFFFAOYSA-N
MW195.27 g/mol
LogP0.72
Rot. Bonds3

About 6-(2-methoxyethyl)-3-methyl-2,4,5,7-tetrahydropyrazolo[3,4-c]pyridine

6-(2-methoxyethyl)-3-methyl-2,4,5,7-tetrahydropyrazolo[3,4-c]pyridine (PubChem CID 118491658) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is 6-(2-methoxyethyl)-3-methyl-2,4,5,7-tetrahydropyrazolo[3,4-c]pyridine.

Molecular Properties

Compound Name6-(2-methoxyethyl)-3-methyl-2,4,5,7-tetrahydropyrazolo[3,4-c]pyridine
PubChem CID118491658
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC Name6-(2-methoxyethyl)-3-methyl-2,4,5,7-tetrahydropyrazolo[3,4-c]pyridine
SMILESCOCCN1CCc2c(n[nH]c2C)C1
InChIInChI=1S/C10H17N3O/c1-8-9-3-4-13(5-6-14-2)7-10(9)12-11-8/h3-7H2,1-2H3,(H,11,12)
InChIKeyOKMYISDQIFQUCK-UHFFFAOYSA-N
XLogP0.72
TPSA41.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 50.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-methyl-1H,4H,5H,6H,7H-pyrazolo(3,4-c)pyridine
CID 71307611
3-(3,5-dimethyl-1H-pyrazol-4-yl)-4-methylmorpholine
CID 126792155
1-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[(1-morpholin-4-ylcyclohexyl)methyl]methanamine
CID 86808371
2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[[(2S)-1,4-dioxan-2-yl]methyl]-N-methylethanamine
CID 124752008
6-Methyl-3-(trifluoromethyl)-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-C]pyridine
CID 50992800
6-Propan-2-yl-3-(trifluoromethyl)-1,4,5,7-tetrahydropyrazolo[3,4-c]pyridine
CID 68211073
1-[3-(Trifluoromethyl)-1,4,5,7-tetrahydropyrazolo[3,4-c]pyridin-6-yl]ethanone
CID 89583878
3-(Fluoromethyl)-6-methyl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine
CID 117956506
3-Methyl-6-(3,3,3-trifluoropropyl)-2,4,5,7-tetrahydropyrazolo[3,4-c]pyridine
CID 118491713
3-Methyl-6-(2,2,2-trifluoroethyl)-2,4,5,7-tetrahydropyrazolo[3,4-c]pyridine
CID 118491775
1-(3-Ethyl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)-3,3,3-trifluoropropan-1-ol
CID 123214791
1-(3-Fluoro-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)ethanone
CID 166919318

Frequently Asked Questions

What is the IUPAC name of 6-(2-methoxyethyl)-3-methyl-2,4,5,7-tetrahydropyrazolo[3,4-c]pyridine?
The IUPAC name of 6-(2-methoxyethyl)-3-methyl-2,4,5,7-tetrahydropyrazolo[3,4-c]pyridine (CID 118491658) is 6-(2-methoxyethyl)-3-methyl-2,4,5,7-tetrahydropyrazolo[3,4-c]pyridine.
What is the SMILES notation for 6-(2-methoxyethyl)-3-methyl-2,4,5,7-tetrahydropyrazolo[3,4-c]pyridine?
The canonical SMILES for 6-(2-methoxyethyl)-3-methyl-2,4,5,7-tetrahydropyrazolo[3,4-c]pyridine is COCCN1CCc2c(n[nH]c2C)C1.
What is the InChIKey of 6-(2-methoxyethyl)-3-methyl-2,4,5,7-tetrahydropyrazolo[3,4-c]pyridine?
The InChIKey is OKMYISDQIFQUCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c1-8-9-3-4-13(5-6-14-2)7-10(9)12-11-8/h3-7H2,1-2H3,(H,11,12).
What are the key properties of 6-(2-methoxyethyl)-3-methyl-2,4,5,7-tetrahydropyrazolo[3,4-c]pyridine?
6-(2-methoxyethyl)-3-methyl-2,4,5,7-tetrahydropyrazolo[3,4-c]pyridine has a molecular weight of 195.27 g/mol, XLogP of 0.72, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-methoxyethyl)-3-methyl-2,4,5,7-tetrahydropyrazolo[3,4-c]pyridine is sourced from PubChem (CID 118491658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).