3,4,6-trimethyl-1-phenylpyrazolo[5,4-b]pyridine

C15H15N3 — CID 754993

IUPAC3,4,6-trimethyl-1-phenylpyrazolo[5,4-b]pyridine
SMILESCc1cc(C)c2c(C)nn(-c3ccccc3)c2n1
InChIInChI=1S/C15H15N3/c1-10-9-11(2)16-15-14(10)12(3)17-18(15)13-7-5-4-6-8-13/h4-9H,1-3H3
InChIKeyFFSUCNQMFARDLC-UHFFFAOYSA-N
MW237.31 g/mol
LogP3.35
Rot. Bonds1

About 3,4,6-trimethyl-1-phenylpyrazolo[5,4-b]pyridine

3,4,6-trimethyl-1-phenylpyrazolo[5,4-b]pyridine (PubChem CID 754993) has the molecular formula C15H15N3 and a molecular weight of 237.31 g/mol. Its IUPAC name is 3,4,6-trimethyl-1-phenylpyrazolo[5,4-b]pyridine.

Molecular Properties

Compound Name3,4,6-trimethyl-1-phenylpyrazolo[5,4-b]pyridine
PubChem CID754993
Molecular FormulaC15H15N3
Molecular Weight237.31 g/mol
Exact Mass237.13
IUPAC Name3,4,6-trimethyl-1-phenylpyrazolo[5,4-b]pyridine
SMILESCc1cc(C)c2c(C)nn(-c3ccccc3)c2n1
InChIInChI=1S/C15H15N3/c1-10-9-11(2)16-15-14(10)12(3)17-18(15)13-7-5-4-6-8-13/h4-9H,1-3H3
InChIKeyFFSUCNQMFARDLC-UHFFFAOYSA-N
XLogP3.35
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.31
LogP ≤ 53.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3,4,6-trimethyl-1-phenylpyrazolo[5,4-b]pyridine?
The IUPAC name of 3,4,6-trimethyl-1-phenylpyrazolo[5,4-b]pyridine (CID 754993) is 3,4,6-trimethyl-1-phenylpyrazolo[5,4-b]pyridine.
What is the SMILES notation for 3,4,6-trimethyl-1-phenylpyrazolo[5,4-b]pyridine?
The canonical SMILES for 3,4,6-trimethyl-1-phenylpyrazolo[5,4-b]pyridine is Cc1cc(C)c2c(C)nn(-c3ccccc3)c2n1.
What is the InChIKey of 3,4,6-trimethyl-1-phenylpyrazolo[5,4-b]pyridine?
The InChIKey is FFSUCNQMFARDLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3/c1-10-9-11(2)16-15-14(10)12(3)17-18(15)13-7-5-4-6-8-13/h4-9H,1-3H3.
What are the key properties of 3,4,6-trimethyl-1-phenylpyrazolo[5,4-b]pyridine?
3,4,6-trimethyl-1-phenylpyrazolo[5,4-b]pyridine has a molecular weight of 237.31 g/mol, XLogP of 3.35, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4,6-trimethyl-1-phenylpyrazolo[5,4-b]pyridine is sourced from PubChem (CID 754993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).