NTSFRWOCQNZBPE-ONNFQVAWSA-N

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

C₂₅H₂₂FN₅O₂ — CID 24852339

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

IUPAC1-(4-fluorophenyl)-3-[(E)-2-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]ethenyl]-6,7-dihydro-5H-imidazo[1,5-a]pyrazin-8-one

SMILESCOc1cc(/C=C/c2nc(-c3ccc(F)cc3)c3n2CCNC3=O)ccc1-n1cnc(C)c1

InChIInChI=1S/C25H22FN5O2/c1-16-14-30(15-28-16)20-9-3-17(13-21(20)33-2)4-10-22-29-23(18-5-7-19(26)8-6-18)24-25(32)27-11-12-31(22)24/h3-10,13-15H,11-12H2,1-2H3,(H,27,32)/b10-4+

InChIKeyNTSFRWOCQNZBPE-ONNFQVAWSA-N

MW443.48 g/mol

LogP4.11

Rot. Bonds5

About NTSFRWOCQNZBPE-ONNFQVAWSA-N

NTSFRWOCQNZBPE-ONNFQVAWSA-N (PubChem CID 24852339) has the molecular formula C₂₅H₂₂FN₅O₂ and a molecular weight of 443.48 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-3-[(E)-2-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]ethenyl]-6,7-dihydro-5H-imidazo[1,5-a]pyrazin-8-one.

Molecular Properties

Compound Name	NTSFRWOCQNZBPE-ONNFQVAWSA-N
PubChem CID	24852339
Molecular Formula	C₂₅H₂₂FN₅O₂
Molecular Weight	443.48 g/mol
Exact Mass	443.18
IUPAC Name	1-(4-fluorophenyl)-3-[(E)-2-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]ethenyl]-6,7-dihydro-5H-imidazo[1,5-a]pyrazin-8-one
SMILES	COc1cc(/C=C/c2nc(-c3ccc(F)cc3)c3n2CCNC3=O)ccc1-n1cnc(C)c1
InChI	InChI=1S/C25H22FN5O2/c1-16-14-30(15-28-16)20-9-3-17(13-21(20)33-2)4-10-22-29-23(18-5-7-19(26)8-6-18)24-25(32)27-11-12-31(22)24/h3-10,13-15H,11-12H2,1-2H3,(H,27,32)/b10-4+
InChIKey	NTSFRWOCQNZBPE-ONNFQVAWSA-N
XLogP	4.11
TPSA	73.97 Å²
H-Bond Donors	1
H-Bond Acceptors	6
Rotatable Bonds	5
Heavy Atoms	33
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	443.48
LogP ≤ 5	4.11
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of NTSFRWOCQNZBPE-ONNFQVAWSA-N?

The IUPAC name of NTSFRWOCQNZBPE-ONNFQVAWSA-N (CID 24852339) is 1-(4-fluorophenyl)-3-[(E)-2-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]ethenyl]-6,7-dihydro-5H-imidazo[1,5-a]pyrazin-8-one.

What is the SMILES notation for NTSFRWOCQNZBPE-ONNFQVAWSA-N?

The canonical SMILES for NTSFRWOCQNZBPE-ONNFQVAWSA-N is COc1cc(/C=C/c2nc(-c3ccc(F)cc3)c3n2CCNC3=O)ccc1-n1cnc(C)c1.

What is the InChIKey of NTSFRWOCQNZBPE-ONNFQVAWSA-N?

The InChIKey is NTSFRWOCQNZBPE-ONNFQVAWSA-N. The full InChI is InChI=1S/C25H22FN5O2/c1-16-14-30(15-28-16)20-9-3-17(13-21(20)33-2)4-10-22-29-23(18-5-7-19(26)8-6-18)24-25(32)27-11-12-31(22)24/h3-10,13-15H,11-12H2,1-2H3,(H,27,32)/b10-4+.

What are the key properties of NTSFRWOCQNZBPE-ONNFQVAWSA-N?

NTSFRWOCQNZBPE-ONNFQVAWSA-N has a molecular weight of 443.48 g/mol, XLogP of 4.11, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for NTSFRWOCQNZBPE-ONNFQVAWSA-N is sourced from PubChem (CID 24852339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Browse: Molecules A–Z · all molecules A–Z · drugs A–Z · protein targets A–Z.

Sources

PubChem CID 24852339 — identifiers, structure, computed properties (public domain)

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