4-fluoro-3-methyl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-c]pyridine

C7H10FN3 — CID 171532141

IUPAC4-fluoro-3-methyl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-c]pyridine
SMILESCc1[nH]nc2c1C(F)CNC2
InChIInChI=1S/C7H10FN3/c1-4-7-5(8)2-9-3-6(7)11-10-4/h5,9H,2-3H2,1H3,(H,10,11)
InChIKeyADMUQHBPNBLNMU-UHFFFAOYSA-N
MW155.18 g/mol
LogP0.83
Rot. Bonds

About 4-fluoro-3-methyl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-c]pyridine

4-fluoro-3-methyl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-c]pyridine (PubChem CID 171532141) has the molecular formula C7H10FN3 and a molecular weight of 155.18 g/mol. Its IUPAC name is 4-fluoro-3-methyl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-c]pyridine.

Molecular Properties

Compound Name4-fluoro-3-methyl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-c]pyridine
PubChem CID171532141
Molecular FormulaC7H10FN3
Molecular Weight155.18 g/mol
Exact Mass155.09
IUPAC Name4-fluoro-3-methyl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-c]pyridine
SMILESCc1[nH]nc2c1C(F)CNC2
InChIInChI=1S/C7H10FN3/c1-4-7-5(8)2-9-3-6(7)11-10-4/h5,9H,2-3H2,1H3,(H,10,11)
InChIKeyADMUQHBPNBLNMU-UHFFFAOYSA-N
XLogP0.83
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.18
LogP ≤ 50.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-fluoro-3-methyl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-c]pyridine?
The IUPAC name of 4-fluoro-3-methyl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-c]pyridine (CID 171532141) is 4-fluoro-3-methyl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-c]pyridine.
What is the SMILES notation for 4-fluoro-3-methyl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-c]pyridine?
The canonical SMILES for 4-fluoro-3-methyl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-c]pyridine is Cc1[nH]nc2c1C(F)CNC2.
What is the InChIKey of 4-fluoro-3-methyl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-c]pyridine?
The InChIKey is ADMUQHBPNBLNMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10FN3/c1-4-7-5(8)2-9-3-6(7)11-10-4/h5,9H,2-3H2,1H3,(H,10,11).
What are the key properties of 4-fluoro-3-methyl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-c]pyridine?
4-fluoro-3-methyl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-c]pyridine has a molecular weight of 155.18 g/mol, XLogP of 0.83, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-3-methyl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-c]pyridine is sourced from PubChem (CID 171532141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).