2-(3,5-difluorophenyl)-2-[2-[4-(1-methoxyethyl)phenyl]-3-oxo-1,4-diazaspiro[4.4]non-1-en-4-yl]acetamide

C24H25F2N3O3 — CID 90787750

IUPAC2-(3,5-difluorophenyl)-2-[2-[4-(1-methoxyethyl)phenyl]-3-oxo-1,4-diazaspiro[4.4]non-1-en-4-yl]acetamide
SMILESCOC(C)c1ccc(C2=NC3(CCCC3)N(C(C(N)=O)c3cc(F)cc(F)c3)C2=O)cc1
InChIInChI=1S/C24H25F2N3O3/c1-14(32-2)15-5-7-16(8-6-15)20-23(31)29(24(28-20)9-3-4-10-24)21(22(27)30)17-11-18(25)13-19(26)12-17/h5-8,11-14,21H,3-4,9-10H2,1-2H3,(H2,27,30)
InChIKeyWXYYWSNUVFJVBT-UHFFFAOYSA-N
MW441.48 g/mol
LogP3.80
Rot. Bonds6

About 2-(3,5-difluorophenyl)-2-[2-[4-(1-methoxyethyl)phenyl]-3-oxo-1,4-diazaspiro[4.4]non-1-en-4-yl]acetamide

2-(3,5-difluorophenyl)-2-[2-[4-(1-methoxyethyl)phenyl]-3-oxo-1,4-diazaspiro[4.4]non-1-en-4-yl]acetamide (PubChem CID 90787750) has the molecular formula C24H25F2N3O3 and a molecular weight of 441.48 g/mol. Its IUPAC name is 2-(3,5-difluorophenyl)-2-[2-[4-(1-methoxyethyl)phenyl]-3-oxo-1,4-diazaspiro[4.4]non-1-en-4-yl]acetamide.

Molecular Properties

Compound Name2-(3,5-difluorophenyl)-2-[2-[4-(1-methoxyethyl)phenyl]-3-oxo-1,4-diazaspiro[4.4]non-1-en-4-yl]acetamide
PubChem CID90787750
Molecular FormulaC24H25F2N3O3
Molecular Weight441.48 g/mol
Exact Mass441.19
IUPAC Name2-(3,5-difluorophenyl)-2-[2-[4-(1-methoxyethyl)phenyl]-3-oxo-1,4-diazaspiro[4.4]non-1-en-4-yl]acetamide
SMILESCOC(C)c1ccc(C2=NC3(CCCC3)N(C(C(N)=O)c3cc(F)cc(F)c3)C2=O)cc1
InChIInChI=1S/C24H25F2N3O3/c1-14(32-2)15-5-7-16(8-6-15)20-23(31)29(24(28-20)9-3-4-10-24)21(22(27)30)17-11-18(25)13-19(26)12-17/h5-8,11-14,21H,3-4,9-10H2,1-2H3,(H2,27,30)
InChIKeyWXYYWSNUVFJVBT-UHFFFAOYSA-N
XLogP3.80
TPSA84.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500441.48
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(3,5-difluorophenyl)-2-[2-[4-(1-methoxyethyl)phenyl]-3-oxo-1,4-diazaspiro[4.4]non-1-en-4-yl]acetamide 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 2-(3,5-difluorophenyl)-2-[2-[4-(1-methoxyethyl)phenyl]-3-oxo-1,4-diazaspiro[4.4]non-1-en-4-yl]acetamide?
The IUPAC name of 2-(3,5-difluorophenyl)-2-[2-[4-(1-methoxyethyl)phenyl]-3-oxo-1,4-diazaspiro[4.4]non-1-en-4-yl]acetamide (CID 90787750) is 2-(3,5-difluorophenyl)-2-[2-[4-(1-methoxyethyl)phenyl]-3-oxo-1,4-diazaspiro[4.4]non-1-en-4-yl]acetamide.
What is the SMILES notation for 2-(3,5-difluorophenyl)-2-[2-[4-(1-methoxyethyl)phenyl]-3-oxo-1,4-diazaspiro[4.4]non-1-en-4-yl]acetamide?
The canonical SMILES for 2-(3,5-difluorophenyl)-2-[2-[4-(1-methoxyethyl)phenyl]-3-oxo-1,4-diazaspiro[4.4]non-1-en-4-yl]acetamide is COC(C)c1ccc(C2=NC3(CCCC3)N(C(C(N)=O)c3cc(F)cc(F)c3)C2=O)cc1.
What is the InChIKey of 2-(3,5-difluorophenyl)-2-[2-[4-(1-methoxyethyl)phenyl]-3-oxo-1,4-diazaspiro[4.4]non-1-en-4-yl]acetamide?
The InChIKey is WXYYWSNUVFJVBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25F2N3O3/c1-14(32-2)15-5-7-16(8-6-15)20-23(31)29(24(28-20)9-3-4-10-24)21(22(27)30)17-11-18(25)13-19(26)12-17/h5-8,11-14,21H,3-4,9-10H2,1-2H3,(H2,27,30).
What are the key properties of 2-(3,5-difluorophenyl)-2-[2-[4-(1-methoxyethyl)phenyl]-3-oxo-1,4-diazaspiro[4.4]non-1-en-4-yl]acetamide?
2-(3,5-difluorophenyl)-2-[2-[4-(1-methoxyethyl)phenyl]-3-oxo-1,4-diazaspiro[4.4]non-1-en-4-yl]acetamide has a molecular weight of 441.48 g/mol, XLogP of 3.80, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-difluorophenyl)-2-[2-[4-(1-methoxyethyl)phenyl]-3-oxo-1,4-diazaspiro[4.4]non-1-en-4-yl]acetamide is sourced from PubChem (CID 90787750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).