2-oxo-N-(2-phenylethyl)-3-[[2-(trifluoromethyl)phenyl]methyl]-1-oxa-3,8-diazaspiro[4.5]decane-8-carboxamide

C24H26F3N3O3 — CID 15942355

IUPAC2-oxo-N-(2-phenylethyl)-3-[[2-(trifluoromethyl)phenyl]methyl]-1-oxa-3,8-diazaspiro[4.5]decane-8-carboxamide
SMILESO=C(NCCc1ccccc1)N1CCC2(CC1)CN(Cc1ccccc1C(F)(F)F)C(=O)O2
InChIInChI=1S/C24H26F3N3O3/c25-24(26,27)20-9-5-4-8-19(20)16-30-17-23(33-22(30)32)11-14-29(15-12-23)21(31)28-13-10-18-6-2-1-3-7-18/h1-9H,10-17H2,(H,28,31)
InChIKeyBSGSXNOPTCWJJA-UHFFFAOYSA-N
MW461.48 g/mol
LogP4.44
Rot. Bonds5

About 2-oxo-N-(2-phenylethyl)-3-[[2-(trifluoromethyl)phenyl]methyl]-1-oxa-3,8-diazaspiro[4.5]decane-8-carboxamide

2-oxo-N-(2-phenylethyl)-3-[[2-(trifluoromethyl)phenyl]methyl]-1-oxa-3,8-diazaspiro[4.5]decane-8-carboxamide (PubChem CID 15942355) has the molecular formula C24H26F3N3O3 and a molecular weight of 461.48 g/mol. Its IUPAC name is 2-oxo-N-(2-phenylethyl)-3-[[2-(trifluoromethyl)phenyl]methyl]-1-oxa-3,8-diazaspiro[4.5]decane-8-carboxamide.

Molecular Properties

Compound Name2-oxo-N-(2-phenylethyl)-3-[[2-(trifluoromethyl)phenyl]methyl]-1-oxa-3,8-diazaspiro[4.5]decane-8-carboxamide
PubChem CID15942355
Molecular FormulaC24H26F3N3O3
Molecular Weight461.48 g/mol
Exact Mass461.19
IUPAC Name2-oxo-N-(2-phenylethyl)-3-[[2-(trifluoromethyl)phenyl]methyl]-1-oxa-3,8-diazaspiro[4.5]decane-8-carboxamide
SMILESO=C(NCCc1ccccc1)N1CCC2(CC1)CN(Cc1ccccc1C(F)(F)F)C(=O)O2
InChIInChI=1S/C24H26F3N3O3/c25-24(26,27)20-9-5-4-8-19(20)16-30-17-23(33-22(30)32)11-14-29(15-12-23)21(31)28-13-10-18-6-2-1-3-7-18/h1-9H,10-17H2,(H,28,31)
InChIKeyBSGSXNOPTCWJJA-UHFFFAOYSA-N
XLogP4.44
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500461.48
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-oxo-N-(2-phenylethyl)-3-[[2-(trifluoromethyl)phenyl]methyl]-1-oxa-3,8-diazaspiro[4.5]decane-8-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-benzyl-8-(2,3-difluoro-4-methylbenzoyl)-1-oxa-3,8-diazaspiro[4.5]decan-2-one
CID 66901855
8-(2-hydroxybenzoyl)-3-(2-phenylethyl)-1-oxa-3,8-diazaspiro[4.5]decan-2-one
CID 70717698
2-oxo-N-(2-phenylethyl)-3-[[2-(trifluoromethyl)phenyl]methyl]-4,5-dihydro-[1,3]oxazolo[3,2-a][1,3,5]triazepine-7-carboxamide
CID 71447641
8-(2,6-dichlorobenzoyl)-3-[(2-fluorophenyl)methyl]-1-oxa-3,8-diazaspiro[4.5]decan-2-one
CID 11992888
(5S)-3-benzyl-9-[2-(pyrrolidin-1-ylmethyl)benzoyl]-1-oxa-3,9-diazaspiro[4.6]undecan-2-one
CID 124977860
(5R)-3-benzyl-7-(2,2-diphenylacetyl)-1-oxa-3,7-diazaspiro[4.4]nonan-2-one
CID 125003734
4-[2-[(4,4-difluoropiperidine-1-carbonyl)amino]ethyl]benzoic acid
CID 166240238
N-(2-phenylethyl)-4-pyrrolidin-1-yl-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide
CID 91908254
3-(2-phenylethyl)-8-[(2S)-pyrrolidine-2-carbonyl]-1-oxa-3,8-diazaspiro[4.5]decan-2-one
CID 70730575
1-[[2-(trifluoromethyl)phenyl]methyl]pyrrolidine-2,4-dione
CID 79515562
(5R)-3-benzyl-9-[2-(morpholin-4-ylmethyl)benzoyl]-1-oxa-3,9-diazaspiro[4.6]undecan-2-one
CID 129456932
3-benzyl-8-[[4-(trifluoromethoxy)phenyl]methyl]-1-oxa-3,8-diazaspiro[4.5]decan-2-one
CID 11993277

Frequently Asked Questions

What is the IUPAC name of 2-oxo-N-(2-phenylethyl)-3-[[2-(trifluoromethyl)phenyl]methyl]-1-oxa-3,8-diazaspiro[4.5]decane-8-carboxamide?
The IUPAC name of 2-oxo-N-(2-phenylethyl)-3-[[2-(trifluoromethyl)phenyl]methyl]-1-oxa-3,8-diazaspiro[4.5]decane-8-carboxamide (CID 15942355) is 2-oxo-N-(2-phenylethyl)-3-[[2-(trifluoromethyl)phenyl]methyl]-1-oxa-3,8-diazaspiro[4.5]decane-8-carboxamide.
What is the SMILES notation for 2-oxo-N-(2-phenylethyl)-3-[[2-(trifluoromethyl)phenyl]methyl]-1-oxa-3,8-diazaspiro[4.5]decane-8-carboxamide?
The canonical SMILES for 2-oxo-N-(2-phenylethyl)-3-[[2-(trifluoromethyl)phenyl]methyl]-1-oxa-3,8-diazaspiro[4.5]decane-8-carboxamide is O=C(NCCc1ccccc1)N1CCC2(CC1)CN(Cc1ccccc1C(F)(F)F)C(=O)O2.
What is the InChIKey of 2-oxo-N-(2-phenylethyl)-3-[[2-(trifluoromethyl)phenyl]methyl]-1-oxa-3,8-diazaspiro[4.5]decane-8-carboxamide?
The InChIKey is BSGSXNOPTCWJJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26F3N3O3/c25-24(26,27)20-9-5-4-8-19(20)16-30-17-23(33-22(30)32)11-14-29(15-12-23)21(31)28-13-10-18-6-2-1-3-7-18/h1-9H,10-17H2,(H,28,31).
What are the key properties of 2-oxo-N-(2-phenylethyl)-3-[[2-(trifluoromethyl)phenyl]methyl]-1-oxa-3,8-diazaspiro[4.5]decane-8-carboxamide?
2-oxo-N-(2-phenylethyl)-3-[[2-(trifluoromethyl)phenyl]methyl]-1-oxa-3,8-diazaspiro[4.5]decane-8-carboxamide has a molecular weight of 461.48 g/mol, XLogP of 4.44, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxo-N-(2-phenylethyl)-3-[[2-(trifluoromethyl)phenyl]methyl]-1-oxa-3,8-diazaspiro[4.5]decane-8-carboxamide is sourced from PubChem (CID 15942355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).