1-cyclohexyl-7-fluoro-3-methylpyrazolo[4,3-c]pyridine

C13H16FN3 — CID 130336019

IUPAC1-cyclohexyl-7-fluoro-3-methylpyrazolo[4,3-c]pyridine
SMILESCc1nn(C2CCCCC2)c2c(F)cncc12
InChIInChI=1S/C13H16FN3/c1-9-11-7-15-8-12(14)13(11)17(16-9)10-5-3-2-4-6-10/h7-8,10H,2-6H2,1H3
InChIKeyHRIIPLRGMRUGIU-UHFFFAOYSA-N
MW233.29 g/mol
LogP3.38
Rot. Bonds1

About 1-cyclohexyl-7-fluoro-3-methylpyrazolo[4,3-c]pyridine

1-cyclohexyl-7-fluoro-3-methylpyrazolo[4,3-c]pyridine (PubChem CID 130336019) has the molecular formula C13H16FN3 and a molecular weight of 233.29 g/mol. Its IUPAC name is 1-cyclohexyl-7-fluoro-3-methylpyrazolo[4,3-c]pyridine.

Molecular Properties

Compound Name1-cyclohexyl-7-fluoro-3-methylpyrazolo[4,3-c]pyridine
PubChem CID130336019
Molecular FormulaC13H16FN3
Molecular Weight233.29 g/mol
Exact Mass233.13
IUPAC Name1-cyclohexyl-7-fluoro-3-methylpyrazolo[4,3-c]pyridine
SMILESCc1nn(C2CCCCC2)c2c(F)cncc12
InChIInChI=1S/C13H16FN3/c1-9-11-7-15-8-12(14)13(11)17(16-9)10-5-3-2-4-6-10/h7-8,10H,2-6H2,1H3
InChIKeyHRIIPLRGMRUGIU-UHFFFAOYSA-N
XLogP3.38
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.29
LogP ≤ 53.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-7-fluoro-3-methylpyrazolo[4,3-c]pyridine?
The IUPAC name of 1-cyclohexyl-7-fluoro-3-methylpyrazolo[4,3-c]pyridine (CID 130336019) is 1-cyclohexyl-7-fluoro-3-methylpyrazolo[4,3-c]pyridine.
What is the SMILES notation for 1-cyclohexyl-7-fluoro-3-methylpyrazolo[4,3-c]pyridine?
The canonical SMILES for 1-cyclohexyl-7-fluoro-3-methylpyrazolo[4,3-c]pyridine is Cc1nn(C2CCCCC2)c2c(F)cncc12.
What is the InChIKey of 1-cyclohexyl-7-fluoro-3-methylpyrazolo[4,3-c]pyridine?
The InChIKey is HRIIPLRGMRUGIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16FN3/c1-9-11-7-15-8-12(14)13(11)17(16-9)10-5-3-2-4-6-10/h7-8,10H,2-6H2,1H3.
What are the key properties of 1-cyclohexyl-7-fluoro-3-methylpyrazolo[4,3-c]pyridine?
1-cyclohexyl-7-fluoro-3-methylpyrazolo[4,3-c]pyridine has a molecular weight of 233.29 g/mol, XLogP of 3.38, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-7-fluoro-3-methylpyrazolo[4,3-c]pyridine is sourced from PubChem (CID 130336019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).