3-(methoxymethyl)-1,7-dimethyl-5,6-dihydro-4H-pyrazolo[3,4-b]pyridine

C10H17N3O — CID 169184809

IUPAC3-(methoxymethyl)-1,7-dimethyl-5,6-dihydro-4H-pyrazolo[3,4-b]pyridine
SMILESCOCc1nn(C)c2c1CCCN2C
InChIInChI=1S/C10H17N3O/c1-12-6-4-5-8-9(7-14-3)11-13(2)10(8)12/h4-7H2,1-3H3
InChIKeyPUAXXYLGFJDHFG-UHFFFAOYSA-N
MW195.27 g/mol
LogP0.95
Rot. Bonds2

About 3-(methoxymethyl)-1,7-dimethyl-5,6-dihydro-4H-pyrazolo[3,4-b]pyridine

3-(methoxymethyl)-1,7-dimethyl-5,6-dihydro-4H-pyrazolo[3,4-b]pyridine (PubChem CID 169184809) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is 3-(methoxymethyl)-1,7-dimethyl-5,6-dihydro-4H-pyrazolo[3,4-b]pyridine.

Molecular Properties

Compound Name3-(methoxymethyl)-1,7-dimethyl-5,6-dihydro-4H-pyrazolo[3,4-b]pyridine
PubChem CID169184809
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC Name3-(methoxymethyl)-1,7-dimethyl-5,6-dihydro-4H-pyrazolo[3,4-b]pyridine
SMILESCOCc1nn(C)c2c1CCCN2C
InChIInChI=1S/C10H17N3O/c1-12-6-4-5-8-9(7-14-3)11-13(2)10(8)12/h4-7H2,1-3H3
InChIKeyPUAXXYLGFJDHFG-UHFFFAOYSA-N
XLogP0.95
TPSA30.29 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 50.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(methoxymethyl)-1,7-dimethyl-5,6-dihydro-4H-pyrazolo[3,4-b]pyridine?
The IUPAC name of 3-(methoxymethyl)-1,7-dimethyl-5,6-dihydro-4H-pyrazolo[3,4-b]pyridine (CID 169184809) is 3-(methoxymethyl)-1,7-dimethyl-5,6-dihydro-4H-pyrazolo[3,4-b]pyridine.
What is the SMILES notation for 3-(methoxymethyl)-1,7-dimethyl-5,6-dihydro-4H-pyrazolo[3,4-b]pyridine?
The canonical SMILES for 3-(methoxymethyl)-1,7-dimethyl-5,6-dihydro-4H-pyrazolo[3,4-b]pyridine is COCc1nn(C)c2c1CCCN2C.
What is the InChIKey of 3-(methoxymethyl)-1,7-dimethyl-5,6-dihydro-4H-pyrazolo[3,4-b]pyridine?
The InChIKey is PUAXXYLGFJDHFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c1-12-6-4-5-8-9(7-14-3)11-13(2)10(8)12/h4-7H2,1-3H3.
What are the key properties of 3-(methoxymethyl)-1,7-dimethyl-5,6-dihydro-4H-pyrazolo[3,4-b]pyridine?
3-(methoxymethyl)-1,7-dimethyl-5,6-dihydro-4H-pyrazolo[3,4-b]pyridine has a molecular weight of 195.27 g/mol, XLogP of 0.95, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methoxymethyl)-1,7-dimethyl-5,6-dihydro-4H-pyrazolo[3,4-b]pyridine is sourced from PubChem (CID 169184809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).