N-(4-fluorophenyl)-2-[2-(4-fluorophenyl)-3-oxo-1,4-diazaspiro[4.4]non-1-en-4-yl]acetamide

C21H19F2N3O2 — CID 2151528

IUPACN-(4-fluorophenyl)-2-[2-(4-fluorophenyl)-3-oxo-1,4-diazaspiro[4.4]non-1-en-4-yl]acetamide
SMILESO=C(CN1C(=O)C(c2ccc(F)cc2)=NC12CCCC2)Nc1ccc(F)cc1
InChIInChI=1S/C21H19F2N3O2/c22-15-5-3-14(4-6-15)19-20(28)26(21(25-19)11-1-2-12-21)13-18(27)24-17-9-7-16(23)8-10-17/h3-10H,1-2,11-13H2,(H,24,27)
InChIKeyUUONPZUCWFVORJ-UHFFFAOYSA-N
MW383.40 g/mol
LogP3.51
Rot. Bonds4

About N-(4-fluorophenyl)-2-[2-(4-fluorophenyl)-3-oxo-1,4-diazaspiro[4.4]non-1-en-4-yl]acetamide

N-(4-fluorophenyl)-2-[2-(4-fluorophenyl)-3-oxo-1,4-diazaspiro[4.4]non-1-en-4-yl]acetamide (PubChem CID 2151528) has the molecular formula C21H19F2N3O2 and a molecular weight of 383.40 g/mol. Its IUPAC name is N-(4-fluorophenyl)-2-[2-(4-fluorophenyl)-3-oxo-1,4-diazaspiro[4.4]non-1-en-4-yl]acetamide.

Molecular Properties

Compound NameN-(4-fluorophenyl)-2-[2-(4-fluorophenyl)-3-oxo-1,4-diazaspiro[4.4]non-1-en-4-yl]acetamide
PubChem CID2151528
Molecular FormulaC21H19F2N3O2
Molecular Weight383.40 g/mol
Exact Mass383.14
IUPAC NameN-(4-fluorophenyl)-2-[2-(4-fluorophenyl)-3-oxo-1,4-diazaspiro[4.4]non-1-en-4-yl]acetamide
SMILESO=C(CN1C(=O)C(c2ccc(F)cc2)=NC12CCCC2)Nc1ccc(F)cc1
InChIInChI=1S/C21H19F2N3O2/c22-15-5-3-14(4-6-15)19-20(28)26(21(25-19)11-1-2-12-21)13-18(27)24-17-9-7-16(23)8-10-17/h3-10H,1-2,11-13H2,(H,24,27)
InChIKeyUUONPZUCWFVORJ-UHFFFAOYSA-N
XLogP3.51
TPSA61.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.40
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-2-[2-(4-fluorophenyl)-3-oxo-1,4-diazaspiro[4.4]non-1-en-4-yl]acetamide?
The IUPAC name of N-(4-fluorophenyl)-2-[2-(4-fluorophenyl)-3-oxo-1,4-diazaspiro[4.4]non-1-en-4-yl]acetamide (CID 2151528) is N-(4-fluorophenyl)-2-[2-(4-fluorophenyl)-3-oxo-1,4-diazaspiro[4.4]non-1-en-4-yl]acetamide.
What is the SMILES notation for N-(4-fluorophenyl)-2-[2-(4-fluorophenyl)-3-oxo-1,4-diazaspiro[4.4]non-1-en-4-yl]acetamide?
The canonical SMILES for N-(4-fluorophenyl)-2-[2-(4-fluorophenyl)-3-oxo-1,4-diazaspiro[4.4]non-1-en-4-yl]acetamide is O=C(CN1C(=O)C(c2ccc(F)cc2)=NC12CCCC2)Nc1ccc(F)cc1.
What is the InChIKey of N-(4-fluorophenyl)-2-[2-(4-fluorophenyl)-3-oxo-1,4-diazaspiro[4.4]non-1-en-4-yl]acetamide?
The InChIKey is UUONPZUCWFVORJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19F2N3O2/c22-15-5-3-14(4-6-15)19-20(28)26(21(25-19)11-1-2-12-21)13-18(27)24-17-9-7-16(23)8-10-17/h3-10H,1-2,11-13H2,(H,24,27).
What are the key properties of N-(4-fluorophenyl)-2-[2-(4-fluorophenyl)-3-oxo-1,4-diazaspiro[4.4]non-1-en-4-yl]acetamide?
N-(4-fluorophenyl)-2-[2-(4-fluorophenyl)-3-oxo-1,4-diazaspiro[4.4]non-1-en-4-yl]acetamide has a molecular weight of 383.40 g/mol, XLogP of 3.51, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-2-[2-(4-fluorophenyl)-3-oxo-1,4-diazaspiro[4.4]non-1-en-4-yl]acetamide is sourced from PubChem (CID 2151528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).