N-[2-[7-[(2,3-difluorophenyl)methyl]-6-oxo-2,7-diazaspiro[4.5]decan-2-yl]-2-oxoethyl]acetamide

C19H23F2N3O3 — CID 45233045

About N-[2-[7-[(2,3-difluorophenyl)methyl]-6-oxo-2,7-diazaspiro[4.5]decan-2-yl]-2-oxoethyl]acetamide

N-[2-[7-[(2,3-difluorophenyl)methyl]-6-oxo-2,7-diazaspiro[4.5]decan-2-yl]-2-oxoethyl]acetamide (PubChem CID 45233045) has the molecular formula C19H23F2N3O3 and a molecular weight of 379.41 g/mol. Its IUPAC name is N-[2-[7-[(2,3-difluorophenyl)methyl]-6-oxo-2,7-diazaspiro[4.5]decan-2-yl]-2-oxoethyl]acetamide.

Molecular Properties

• Compound Name: N-[2-[7-[(2,3-difluorophenyl)methyl]-6-oxo-2,7-diazaspiro[4.5]decan-2-yl]-2-oxoethyl]acetamide
• PubChem CID: 45233045
• Molecular Formula: C19H23F2N3O3
• Molecular Weight: 379.41 g/mol
• Exact Mass: 379.17
• IUPAC Name: N-[2-[7-[(2,3-difluorophenyl)methyl]-6-oxo-2,7-diazaspiro[4.5]decan-2-yl]-2-oxoethyl]acetamide
• SMILES: CC(=O)NCC(=O)N1CCC2(CCCN(Cc3cccc(F)c3F)C2=O)C1
• InChI: InChI=1S/C19H23F2N3O3/c1-13(25)22-10-16(26)24-9-7-19(12-24)6-3-8-23(18(19)27)11-14-4-2-5-15(20)17(14)21/h2,4-5H,3,6-12H2,1H3,(H,22,25)
• InChIKey: NVTAWHKIKFCEOV-UHFFFAOYSA-N
• XLogP: 1.44
• TPSA: 69.72 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 3
• Rotatable Bonds: 4
• Heavy Atoms: 27
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	379.41
LogP ≤ 5	1.44
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	3

Frequently Asked Questions

What is the IUPAC name of N-[2-[7-[(2,3-difluorophenyl)methyl]-6-oxo-2,7-diazaspiro[4.5]decan-2-yl]-2-oxoethyl]acetamide?

The IUPAC name of N-[2-[7-[(2,3-difluorophenyl)methyl]-6-oxo-2,7-diazaspiro[4.5]decan-2-yl]-2-oxoethyl]acetamide (CID 45233045) is N-[2-[7-[(2,3-difluorophenyl)methyl]-6-oxo-2,7-diazaspiro[4.5]decan-2-yl]-2-oxoethyl]acetamide.

What is the SMILES notation for N-[2-[7-[(2,3-difluorophenyl)methyl]-6-oxo-2,7-diazaspiro[4.5]decan-2-yl]-2-oxoethyl]acetamide?

The canonical SMILES for N-[2-[7-[(2,3-difluorophenyl)methyl]-6-oxo-2,7-diazaspiro[4.5]decan-2-yl]-2-oxoethyl]acetamide is CC(=O)NCC(=O)N1CCC2(CCCN(Cc3cccc(F)c3F)C2=O)C1.

What is the InChIKey of N-[2-[7-[(2,3-difluorophenyl)methyl]-6-oxo-2,7-diazaspiro[4.5]decan-2-yl]-2-oxoethyl]acetamide?

The InChIKey is NVTAWHKIKFCEOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23F2N3O3/c1-13(25)22-10-16(26)24-9-7-19(12-24)6-3-8-23(18(19)27)11-14-4-2-5-15(20)17(14)21/h2,4-5H,3,6-12H2,1H3,(H,22,25).

What are the key properties of N-[2-[7-[(2,3-difluorophenyl)methyl]-6-oxo-2,7-diazaspiro[4.5]decan-2-yl]-2-oxoethyl]acetamide?

N-[2-[7-[(2,3-difluorophenyl)methyl]-6-oxo-2,7-diazaspiro[4.5]decan-2-yl]-2-oxoethyl]acetamide has a molecular weight of 379.41 g/mol, XLogP of 1.44, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for N-[2-[7-[(2,3-difluorophenyl)methyl]-6-oxo-2,7-diazaspiro[4.5]decan-2-yl]-2-oxoethyl]acetamide is sourced from PubChem (CID 45233045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).