3-(8-methyl-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl)benzamide

C22H25N3O2 — CID 170237616

IUPAC3-(8-methyl-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl)benzamide
SMILESCC1(c2ccccc2)CCC2(CC1)CN(c1cccc(C(N)=O)c1)C(=O)N2
InChIInChI=1S/C22H25N3O2/c1-21(17-7-3-2-4-8-17)10-12-22(13-11-21)15-25(20(27)24-22)18-9-5-6-16(14-18)19(23)26/h2-9,14H,10-13,15H2,1H3,(H2,23,26)(H,24,27)
InChIKeyIJHGYRJGBXJQAK-UHFFFAOYSA-N
MW363.46 g/mol
LogP3.59
Rot. Bonds3

About 3-(8-methyl-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl)benzamide

3-(8-methyl-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl)benzamide (PubChem CID 170237616) has the molecular formula C22H25N3O2 and a molecular weight of 363.46 g/mol. Its IUPAC name is 3-(8-methyl-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl)benzamide.

Molecular Properties

Compound Name3-(8-methyl-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl)benzamide
PubChem CID170237616
Molecular FormulaC22H25N3O2
Molecular Weight363.46 g/mol
Exact Mass363.19
IUPAC Name3-(8-methyl-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl)benzamide
SMILESCC1(c2ccccc2)CCC2(CC1)CN(c1cccc(C(N)=O)c1)C(=O)N2
InChIInChI=1S/C22H25N3O2/c1-21(17-7-3-2-4-8-17)10-12-22(13-11-21)15-25(20(27)24-22)18-9-5-6-16(14-18)19(23)26/h2-9,14H,10-13,15H2,1H3,(H2,23,26)(H,24,27)
InChIKeyIJHGYRJGBXJQAK-UHFFFAOYSA-N
XLogP3.59
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.46
LogP ≤ 53.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(8-methyl-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl)benzamide?
The IUPAC name of 3-(8-methyl-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl)benzamide (CID 170237616) is 3-(8-methyl-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl)benzamide.
What is the SMILES notation for 3-(8-methyl-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl)benzamide?
The canonical SMILES for 3-(8-methyl-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl)benzamide is CC1(c2ccccc2)CCC2(CC1)CN(c1cccc(C(N)=O)c1)C(=O)N2.
What is the InChIKey of 3-(8-methyl-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl)benzamide?
The InChIKey is IJHGYRJGBXJQAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25N3O2/c1-21(17-7-3-2-4-8-17)10-12-22(13-11-21)15-25(20(27)24-22)18-9-5-6-16(14-18)19(23)26/h2-9,14H,10-13,15H2,1H3,(H2,23,26)(H,24,27).
What are the key properties of 3-(8-methyl-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl)benzamide?
3-(8-methyl-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl)benzamide has a molecular weight of 363.46 g/mol, XLogP of 3.59, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(8-methyl-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl)benzamide is sourced from PubChem (CID 170237616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).