GOLPTMJECXBNMS-XUZZJYLKSA-N

Name: GOLPTMJECXBNMS-XUZZJYLKSA-N — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₂₆H₂₁F₃N₄O₂ — CID 138684578

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

IUPAC2,2-difluoro-N-[(2R,3S)-1-[1-(4-fluorophenyl)indazol-5-yl]-5-oxo-2-phenylpyrrolidin-3-yl]propanamide

SMILESCC(F)(F)C(=O)N[C@H]1CC(=O)N(c2ccc3c(cnn3-c3ccc(F)cc3)c2)[C@@H]1c1ccccc1

InChIInChI=1S/C26H21F3N4O2/c1-26(28,29)25(35)31-21-14-23(34)32(24(21)16-5-3-2-4-6-16)20-11-12-22-17(13-20)15-30-33(22)19-9-7-18(27)8-10-19/h2-13,15,21,24H,14H2,1H3,(H,31,35)/t21-,24+/m0/s1

InChIKeyGOLPTMJECXBNMS-XUZZJYLKSA-N

MW478.47 g/mol

LogP4.78

Rot. Bonds5

About GOLPTMJECXBNMS-XUZZJYLKSA-N

GOLPTMJECXBNMS-XUZZJYLKSA-N (PubChem CID 138684578) has the molecular formula C₂₆H₂₁F₃N₄O₂ and a molecular weight of 478.47 g/mol. Its IUPAC name is 2,2-difluoro-N-[(2R,3S)-1-[1-(4-fluorophenyl)indazol-5-yl]-5-oxo-2-phenylpyrrolidin-3-yl]propanamide.

Molecular Properties

Compound Name	GOLPTMJECXBNMS-XUZZJYLKSA-N
PubChem CID	138684578
Molecular Formula	C₂₆H₂₁F₃N₄O₂
Molecular Weight	478.47 g/mol
Exact Mass	478.16
IUPAC Name	2,2-difluoro-N-[(2R,3S)-1-[1-(4-fluorophenyl)indazol-5-yl]-5-oxo-2-phenylpyrrolidin-3-yl]propanamide
SMILES	CC(F)(F)C(=O)N[C@H]1CC(=O)N(c2ccc3c(cnn3-c3ccc(F)cc3)c2)[C@@H]1c1ccccc1
InChI	InChI=1S/C26H21F3N4O2/c1-26(28,29)25(35)31-21-14-23(34)32(24(21)16-5-3-2-4-6-16)20-11-12-22-17(13-20)15-30-33(22)19-9-7-18(27)8-10-19/h2-13,15,21,24H,14H2,1H3,(H,31,35)/t21-,24+/m0/s1
InChIKey	GOLPTMJECXBNMS-XUZZJYLKSA-N
XLogP	4.78
TPSA	67.23 Å²
H-Bond Donors	1
H-Bond Acceptors	4
Rotatable Bonds	5
Heavy Atoms	35
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	478.47
LogP ≤ 5	4.78
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of GOLPTMJECXBNMS-XUZZJYLKSA-N?

The IUPAC name of GOLPTMJECXBNMS-XUZZJYLKSA-N (CID 138684578) is 2,2-difluoro-N-[(2R,3S)-1-[1-(4-fluorophenyl)indazol-5-yl]-5-oxo-2-phenylpyrrolidin-3-yl]propanamide.

What is the SMILES notation for GOLPTMJECXBNMS-XUZZJYLKSA-N?

The canonical SMILES for GOLPTMJECXBNMS-XUZZJYLKSA-N is CC(F)(F)C(=O)N[C@H]1CC(=O)N(c2ccc3c(cnn3-c3ccc(F)cc3)c2)[C@@H]1c1ccccc1.

What is the InChIKey of GOLPTMJECXBNMS-XUZZJYLKSA-N?

The InChIKey is GOLPTMJECXBNMS-XUZZJYLKSA-N. The full InChI is InChI=1S/C26H21F3N4O2/c1-26(28,29)25(35)31-21-14-23(34)32(24(21)16-5-3-2-4-6-16)20-11-12-22-17(13-20)15-30-33(22)19-9-7-18(27)8-10-19/h2-13,15,21,24H,14H2,1H3,(H,31,35)/t21-,24+/m0/s1.

What are the key properties of GOLPTMJECXBNMS-XUZZJYLKSA-N?

GOLPTMJECXBNMS-XUZZJYLKSA-N has a molecular weight of 478.47 g/mol, XLogP of 4.78, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for GOLPTMJECXBNMS-XUZZJYLKSA-N is sourced from PubChem (CID 138684578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 138684578 — identifiers, structure, computed properties (public domain)

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