N-(2,3-dihydro-1H-inden-5-yl)-2-oxo-2-(4-phenoxypiperidin-1-yl)acetamide

C22H24N2O3 — CID 47695218

IUPACN-(2,3-dihydro-1H-inden-5-yl)-2-oxo-2-(4-phenoxypiperidin-1-yl)acetamide
SMILESO=C(Nc1ccc2c(c1)CCC2)C(=O)N1CCC(Oc2ccccc2)CC1
InChIInChI=1S/C22H24N2O3/c25-21(23-18-10-9-16-5-4-6-17(16)15-18)22(26)24-13-11-20(12-14-24)27-19-7-2-1-3-8-19/h1-3,7-10,15,20H,4-6,11-14H2,(H,23,25)
InChIKeyFESIPJRISCRWNJ-UHFFFAOYSA-N
MW364.44 g/mol
LogP3.18
Rot. Bonds3

About N-(2,3-dihydro-1H-inden-5-yl)-2-oxo-2-(4-phenoxypiperidin-1-yl)acetamide

N-(2,3-dihydro-1H-inden-5-yl)-2-oxo-2-(4-phenoxypiperidin-1-yl)acetamide (PubChem CID 47695218) has the molecular formula C22H24N2O3 and a molecular weight of 364.44 g/mol. Its IUPAC name is N-(2,3-dihydro-1H-inden-5-yl)-2-oxo-2-(4-phenoxypiperidin-1-yl)acetamide.

Molecular Properties

Compound NameN-(2,3-dihydro-1H-inden-5-yl)-2-oxo-2-(4-phenoxypiperidin-1-yl)acetamide
PubChem CID47695218
Molecular FormulaC22H24N2O3
Molecular Weight364.44 g/mol
Exact Mass364.18
IUPAC NameN-(2,3-dihydro-1H-inden-5-yl)-2-oxo-2-(4-phenoxypiperidin-1-yl)acetamide
SMILESO=C(Nc1ccc2c(c1)CCC2)C(=O)N1CCC(Oc2ccccc2)CC1
InChIInChI=1S/C22H24N2O3/c25-21(23-18-10-9-16-5-4-6-17(16)15-18)22(26)24-13-11-20(12-14-24)27-19-7-2-1-3-8-19/h1-3,7-10,15,20H,4-6,11-14H2,(H,23,25)
InChIKeyFESIPJRISCRWNJ-UHFFFAOYSA-N
XLogP3.18
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.44
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Related Compounds

(3S)-N-(2,3-dihydro-1H-inden-5-yl)-3-pyridin-3-yloxypyrrolidine-1-carboxamide
CID 97078501
N-[4-(methanesulfonamido)phenyl]-2-[4-(4-methylphenoxy)piperidin-1-yl]-2-oxoacetamide
CID 76852356
2-[4-(4-chlorophenoxy)piperidin-1-yl]-2-oxo-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)acetamide
CID 10201898
(3R)-N-(2,3-dihydro-1H-inden-5-yl)-3-hydroxypyrrolidine-1-carboxamide
CID 111431168
1-acetyl-N-(2,3-dihydro-1H-inden-5-yl)piperidine-4-carboxamide
CID 6468881
1-[2-oxo-2-(4-phenoxyanilino)acetyl]piperidine-4-carboxamide
CID 44902818
phenyl 4-phenoxypiperidine-1-carboxylate
CID 110396730
N-(2,3-dihydro-1H-inden-5-yl)-2-hydrazinyl-2-oxoacetamide
CID 43163947
(4-phenoxypiperidin-1-yl)-piperidin-2-ylmethanone
CID 60859991
(2S)-1-(2,3-dihydro-1H-inden-5-ylcarbamoyl)pyrrolidine-2-carboxylic acid
CID 61185659
1-[2-[(1-acetyl-3,4-dihydro-2H-quinolin-7-yl)amino]-2-oxoacetyl]piperidine-4-carboxamide
CID 7586451
methyl 3-phenoxypyrrolidine-1-carboxylate
CID 58171478

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydro-1H-inden-5-yl)-2-oxo-2-(4-phenoxypiperidin-1-yl)acetamide?
The IUPAC name of N-(2,3-dihydro-1H-inden-5-yl)-2-oxo-2-(4-phenoxypiperidin-1-yl)acetamide (CID 47695218) is N-(2,3-dihydro-1H-inden-5-yl)-2-oxo-2-(4-phenoxypiperidin-1-yl)acetamide.
What is the SMILES notation for N-(2,3-dihydro-1H-inden-5-yl)-2-oxo-2-(4-phenoxypiperidin-1-yl)acetamide?
The canonical SMILES for N-(2,3-dihydro-1H-inden-5-yl)-2-oxo-2-(4-phenoxypiperidin-1-yl)acetamide is O=C(Nc1ccc2c(c1)CCC2)C(=O)N1CCC(Oc2ccccc2)CC1.
What is the InChIKey of N-(2,3-dihydro-1H-inden-5-yl)-2-oxo-2-(4-phenoxypiperidin-1-yl)acetamide?
The InChIKey is FESIPJRISCRWNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N2O3/c25-21(23-18-10-9-16-5-4-6-17(16)15-18)22(26)24-13-11-20(12-14-24)27-19-7-2-1-3-8-19/h1-3,7-10,15,20H,4-6,11-14H2,(H,23,25).
What are the key properties of N-(2,3-dihydro-1H-inden-5-yl)-2-oxo-2-(4-phenoxypiperidin-1-yl)acetamide?
N-(2,3-dihydro-1H-inden-5-yl)-2-oxo-2-(4-phenoxypiperidin-1-yl)acetamide has a molecular weight of 364.44 g/mol, XLogP of 3.18, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydro-1H-inden-5-yl)-2-oxo-2-(4-phenoxypiperidin-1-yl)acetamide is sourced from PubChem (CID 47695218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).