3-fluoro-1,5-dimethyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine

C8H12FN3 — CID 145046744

IUPAC3-fluoro-1,5-dimethyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine
SMILESCN1CCc2c(c(F)nn2C)C1
InChIInChI=1S/C8H12FN3/c1-11-4-3-7-6(5-11)8(9)10-12(7)2/h3-5H2,1-2H3
InChIKeyOOKYKEDFJVDWRB-UHFFFAOYSA-N
MW169.20 g/mol
LogP0.55
Rot. Bonds

About 3-fluoro-1,5-dimethyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine

3-fluoro-1,5-dimethyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine (PubChem CID 145046744) has the molecular formula C8H12FN3 and a molecular weight of 169.20 g/mol. Its IUPAC name is 3-fluoro-1,5-dimethyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine.

Molecular Properties

Compound Name3-fluoro-1,5-dimethyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine
PubChem CID145046744
Molecular FormulaC8H12FN3
Molecular Weight169.20 g/mol
Exact Mass169.10
IUPAC Name3-fluoro-1,5-dimethyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine
SMILESCN1CCc2c(c(F)nn2C)C1
InChIInChI=1S/C8H12FN3/c1-11-4-3-7-6(5-11)8(9)10-12(7)2/h3-5H2,1-2H3
InChIKeyOOKYKEDFJVDWRB-UHFFFAOYSA-N
XLogP0.55
TPSA21.06 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.20
LogP ≤ 50.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-fluoro-1,5-dimethyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine?
The IUPAC name of 3-fluoro-1,5-dimethyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine (CID 145046744) is 3-fluoro-1,5-dimethyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine.
What is the SMILES notation for 3-fluoro-1,5-dimethyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine?
The canonical SMILES for 3-fluoro-1,5-dimethyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine is CN1CCc2c(c(F)nn2C)C1.
What is the InChIKey of 3-fluoro-1,5-dimethyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine?
The InChIKey is OOKYKEDFJVDWRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12FN3/c1-11-4-3-7-6(5-11)8(9)10-12(7)2/h3-5H2,1-2H3.
What are the key properties of 3-fluoro-1,5-dimethyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine?
3-fluoro-1,5-dimethyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine has a molecular weight of 169.20 g/mol, XLogP of 0.55, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-1,5-dimethyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine is sourced from PubChem (CID 145046744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).