2-phenyl-5-[1-(2-pyrrolidin-1-ylethyl)indazol-5-yl]furo[3,2-c]pyridin-4-one

C26H24N4O2 — CID 24857597

IUPAC2-phenyl-5-[1-(2-pyrrolidin-1-ylethyl)indazol-5-yl]furo[3,2-c]pyridin-4-one
SMILESO=c1c2cc(-c3ccccc3)oc2ccn1-c1ccc2c(cnn2CCN2CCCC2)c1
InChIInChI=1S/C26H24N4O2/c31-26-22-17-25(19-6-2-1-3-7-19)32-24(22)10-13-29(26)21-8-9-23-20(16-21)18-27-30(23)15-14-28-11-4-5-12-28/h1-3,6-10,13,16-18H,4-5,11-12,14-15H2
InChIKeyAZTUEMJLQCTRMN-UHFFFAOYSA-N
MW424.50 g/mol
LogP4.70
Rot. Bonds5

About 2-phenyl-5-[1-(2-pyrrolidin-1-ylethyl)indazol-5-yl]furo[3,2-c]pyridin-4-one

2-phenyl-5-[1-(2-pyrrolidin-1-ylethyl)indazol-5-yl]furo[3,2-c]pyridin-4-one (PubChem CID 24857597) has the molecular formula C26H24N4O2 and a molecular weight of 424.50 g/mol. Its IUPAC name is 2-phenyl-5-[1-(2-pyrrolidin-1-ylethyl)indazol-5-yl]furo[3,2-c]pyridin-4-one.

Molecular Properties

Compound Name2-phenyl-5-[1-(2-pyrrolidin-1-ylethyl)indazol-5-yl]furo[3,2-c]pyridin-4-one
PubChem CID24857597
Molecular FormulaC26H24N4O2
Molecular Weight424.50 g/mol
Exact Mass424.19
IUPAC Name2-phenyl-5-[1-(2-pyrrolidin-1-ylethyl)indazol-5-yl]furo[3,2-c]pyridin-4-one
SMILESO=c1c2cc(-c3ccccc3)oc2ccn1-c1ccc2c(cnn2CCN2CCCC2)c1
InChIInChI=1S/C26H24N4O2/c31-26-22-17-25(19-6-2-1-3-7-19)32-24(22)10-13-29(26)21-8-9-23-20(16-21)18-27-30(23)15-14-28-11-4-5-12-28/h1-3,6-10,13,16-18H,4-5,11-12,14-15H2
InChIKeyAZTUEMJLQCTRMN-UHFFFAOYSA-N
XLogP4.70
TPSA56.20 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500424.50
LogP ≤ 54.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-phenyl-5-[1-(2-pyrrolidin-1-ylethyl)indazol-5-yl]furo[3,2-c]pyridin-4-one?
The IUPAC name of 2-phenyl-5-[1-(2-pyrrolidin-1-ylethyl)indazol-5-yl]furo[3,2-c]pyridin-4-one (CID 24857597) is 2-phenyl-5-[1-(2-pyrrolidin-1-ylethyl)indazol-5-yl]furo[3,2-c]pyridin-4-one.
What is the SMILES notation for 2-phenyl-5-[1-(2-pyrrolidin-1-ylethyl)indazol-5-yl]furo[3,2-c]pyridin-4-one?
The canonical SMILES for 2-phenyl-5-[1-(2-pyrrolidin-1-ylethyl)indazol-5-yl]furo[3,2-c]pyridin-4-one is O=c1c2cc(-c3ccccc3)oc2ccn1-c1ccc2c(cnn2CCN2CCCC2)c1.
What is the InChIKey of 2-phenyl-5-[1-(2-pyrrolidin-1-ylethyl)indazol-5-yl]furo[3,2-c]pyridin-4-one?
The InChIKey is AZTUEMJLQCTRMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H24N4O2/c31-26-22-17-25(19-6-2-1-3-7-19)32-24(22)10-13-29(26)21-8-9-23-20(16-21)18-27-30(23)15-14-28-11-4-5-12-28/h1-3,6-10,13,16-18H,4-5,11-12,14-15H2.
What are the key properties of 2-phenyl-5-[1-(2-pyrrolidin-1-ylethyl)indazol-5-yl]furo[3,2-c]pyridin-4-one?
2-phenyl-5-[1-(2-pyrrolidin-1-ylethyl)indazol-5-yl]furo[3,2-c]pyridin-4-one has a molecular weight of 424.50 g/mol, XLogP of 4.70, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-5-[1-(2-pyrrolidin-1-ylethyl)indazol-5-yl]furo[3,2-c]pyridin-4-one is sourced from PubChem (CID 24857597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).