(2R)-N-(6-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)-5-oxopyrrolidine-2-carboxamide

C22H17FN4O2 — CID 58582146

IUPAC(2R)-N-(6-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)-5-oxopyrrolidine-2-carboxamide
SMILESO=C1CC[C@H](C(=O)Nc2cc3c(-c4ccc5ccccc5c4)n[nH]c3cc2F)N1
InChIInChI=1S/C22H17FN4O2/c23-16-11-18-15(10-19(16)25-22(29)17-7-8-20(28)24-17)21(27-26-18)14-6-5-12-3-1-2-4-13(12)9-14/h1-6,9-11,17H,7-8H2,(H,24,28)(H,25,29)(H,26,27)/t17-/m1/s1
InChIKeyOWUXFQYPLWRVAX-QGZVFWFLSA-N
MW388.40 g/mol
LogP3.74
Rot. Bonds3

About (2R)-N-(6-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)-5-oxopyrrolidine-2-carboxamide

(2R)-N-(6-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)-5-oxopyrrolidine-2-carboxamide (PubChem CID 58582146) has the molecular formula C22H17FN4O2 and a molecular weight of 388.40 g/mol. Its IUPAC name is (2R)-N-(6-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)-5-oxopyrrolidine-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-(6-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)-5-oxopyrrolidine-2-carboxamide
PubChem CID58582146
Molecular FormulaC22H17FN4O2
Molecular Weight388.40 g/mol
Exact Mass388.13
IUPAC Name(2R)-N-(6-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)-5-oxopyrrolidine-2-carboxamide
SMILESO=C1CC[C@H](C(=O)Nc2cc3c(-c4ccc5ccccc5c4)n[nH]c3cc2F)N1
InChIInChI=1S/C22H17FN4O2/c23-16-11-18-15(10-19(16)25-22(29)17-7-8-20(28)24-17)21(27-26-18)14-6-5-12-3-1-2-4-13(12)9-14/h1-6,9-11,17H,7-8H2,(H,24,28)(H,25,29)(H,26,27)/t17-/m1/s1
InChIKeyOWUXFQYPLWRVAX-QGZVFWFLSA-N
XLogP3.74
TPSA86.88 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.40
LogP ≤ 53.74
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze (2R)-N-(6-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)-5-oxopyrrolidine-2-carboxamide 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 (2R)-N-(6-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)-5-oxopyrrolidine-2-carboxamide?
The IUPAC name of (2R)-N-(6-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)-5-oxopyrrolidine-2-carboxamide (CID 58582146) is (2R)-N-(6-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)-5-oxopyrrolidine-2-carboxamide.
What is the SMILES notation for (2R)-N-(6-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)-5-oxopyrrolidine-2-carboxamide?
The canonical SMILES for (2R)-N-(6-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)-5-oxopyrrolidine-2-carboxamide is O=C1CC[C@H](C(=O)Nc2cc3c(-c4ccc5ccccc5c4)n[nH]c3cc2F)N1.
What is the InChIKey of (2R)-N-(6-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)-5-oxopyrrolidine-2-carboxamide?
The InChIKey is OWUXFQYPLWRVAX-QGZVFWFLSA-N. The full InChI is InChI=1S/C22H17FN4O2/c23-16-11-18-15(10-19(16)25-22(29)17-7-8-20(28)24-17)21(27-26-18)14-6-5-12-3-1-2-4-13(12)9-14/h1-6,9-11,17H,7-8H2,(H,24,28)(H,25,29)(H,26,27)/t17-/m1/s1.
What are the key properties of (2R)-N-(6-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)-5-oxopyrrolidine-2-carboxamide?
(2R)-N-(6-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)-5-oxopyrrolidine-2-carboxamide has a molecular weight of 388.40 g/mol, XLogP of 3.74, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(6-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)-5-oxopyrrolidine-2-carboxamide is sourced from PubChem (CID 58582146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).