2-pyrazolo[1,5-a]pyridin-3-ylfluoren-9-one

C40H24N4O2 — CID 170173540

IUPAC2-pyrazolo[1,5-a]pyridin-3-ylfluoren-9-one
SMILESO=C1c2ccccc2-c2ccc(-c3cnn4ccccc34)cc21.O=C1c2ccccc2-c2ccc(-c3cnn4ccccc34)cc21
InChIInChI=1S/2C20H12N2O/c2*23-20-16-6-2-1-5-14(16)15-9-8-13(11-17(15)20)18-12-21-22-10-4-3-7-19(18)22/h2*1-12H
InChIKeyMQXYTBCSTOMNFU-UHFFFAOYSA-N
MW592.66 g/mol
LogP8.43
Rot. Bonds2

About 2-pyrazolo[1,5-a]pyridin-3-ylfluoren-9-one

2-pyrazolo[1,5-a]pyridin-3-ylfluoren-9-one (PubChem CID 170173540) has the molecular formula C40H24N4O2 and a molecular weight of 592.66 g/mol. Its IUPAC name is 2-pyrazolo[1,5-a]pyridin-3-ylfluoren-9-one.

Molecular Properties

Compound Name2-pyrazolo[1,5-a]pyridin-3-ylfluoren-9-one
PubChem CID170173540
Molecular FormulaC40H24N4O2
Molecular Weight592.66 g/mol
Exact Mass592.19
IUPAC Name2-pyrazolo[1,5-a]pyridin-3-ylfluoren-9-one
SMILESO=C1c2ccccc2-c2ccc(-c3cnn4ccccc34)cc21.O=C1c2ccccc2-c2ccc(-c3cnn4ccccc34)cc21
InChIInChI=1S/2C20H12N2O/c2*23-20-16-6-2-1-5-14(16)15-9-8-13(11-17(15)20)18-12-21-22-10-4-3-7-19(18)22/h2*1-12H
InChIKeyMQXYTBCSTOMNFU-UHFFFAOYSA-N
XLogP8.43
TPSA68.74 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms46
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500592.66
LogP ≤ 58.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 2-pyrazolo[1,5-a]pyridin-3-ylfluoren-9-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-pyrazolo[1,5-a]pyridin-3-ylfluoren-9-one?
The IUPAC name of 2-pyrazolo[1,5-a]pyridin-3-ylfluoren-9-one (CID 170173540) is 2-pyrazolo[1,5-a]pyridin-3-ylfluoren-9-one.
What is the SMILES notation for 2-pyrazolo[1,5-a]pyridin-3-ylfluoren-9-one?
The canonical SMILES for 2-pyrazolo[1,5-a]pyridin-3-ylfluoren-9-one is O=C1c2ccccc2-c2ccc(-c3cnn4ccccc34)cc21.O=C1c2ccccc2-c2ccc(-c3cnn4ccccc34)cc21.
What is the InChIKey of 2-pyrazolo[1,5-a]pyridin-3-ylfluoren-9-one?
The InChIKey is MQXYTBCSTOMNFU-UHFFFAOYSA-N. The full InChI is InChI=1S/2C20H12N2O/c2*23-20-16-6-2-1-5-14(16)15-9-8-13(11-17(15)20)18-12-21-22-10-4-3-7-19(18)22/h2*1-12H.
What are the key properties of 2-pyrazolo[1,5-a]pyridin-3-ylfluoren-9-one?
2-pyrazolo[1,5-a]pyridin-3-ylfluoren-9-one has a molecular weight of 592.66 g/mol, XLogP of 8.43, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyrazolo[1,5-a]pyridin-3-ylfluoren-9-one is sourced from PubChem (CID 170173540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).