N-cyclopropyl-2-[1'-(2-methoxyacetyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide

C21H28N2O3 — CID 118741226

IUPACN-cyclopropyl-2-[1'-(2-methoxyacetyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide
SMILESCOCC(=O)N1CCC2(CC1)CC(CC(=O)NC1CC1)c1ccccc12
InChIInChI=1S/C21H28N2O3/c1-26-14-20(25)23-10-8-21(9-11-23)13-15(12-19(24)22-16-6-7-16)17-4-2-3-5-18(17)21/h2-5,15-16H,6-14H2,1H3,(H,22,24)
InChIKeyNSMPPJNSFVDYFD-UHFFFAOYSA-N
MW356.47 g/mol
LogP2.35
Rot. Bonds5

About N-cyclopropyl-2-[1'-(2-methoxyacetyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide

N-cyclopropyl-2-[1'-(2-methoxyacetyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide (PubChem CID 118741226) has the molecular formula C21H28N2O3 and a molecular weight of 356.47 g/mol. Its IUPAC name is N-cyclopropyl-2-[1'-(2-methoxyacetyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[1'-(2-methoxyacetyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide
PubChem CID118741226
Molecular FormulaC21H28N2O3
Molecular Weight356.47 g/mol
Exact Mass356.21
IUPAC NameN-cyclopropyl-2-[1'-(2-methoxyacetyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide
SMILESCOCC(=O)N1CCC2(CC1)CC(CC(=O)NC1CC1)c1ccccc12
InChIInChI=1S/C21H28N2O3/c1-26-14-20(25)23-10-8-21(9-11-23)13-15(12-19(24)22-16-6-7-16)17-4-2-3-5-18(17)21/h2-5,15-16H,6-14H2,1H3,(H,22,24)
InChIKeyNSMPPJNSFVDYFD-UHFFFAOYSA-N
XLogP2.35
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.47
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[1'-(2-methoxyacetyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide?
The IUPAC name of N-cyclopropyl-2-[1'-(2-methoxyacetyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide (CID 118741226) is N-cyclopropyl-2-[1'-(2-methoxyacetyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide.
What is the SMILES notation for N-cyclopropyl-2-[1'-(2-methoxyacetyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide?
The canonical SMILES for N-cyclopropyl-2-[1'-(2-methoxyacetyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide is COCC(=O)N1CCC2(CC1)CC(CC(=O)NC1CC1)c1ccccc12.
What is the InChIKey of N-cyclopropyl-2-[1'-(2-methoxyacetyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide?
The InChIKey is NSMPPJNSFVDYFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H28N2O3/c1-26-14-20(25)23-10-8-21(9-11-23)13-15(12-19(24)22-16-6-7-16)17-4-2-3-5-18(17)21/h2-5,15-16H,6-14H2,1H3,(H,22,24).
What are the key properties of N-cyclopropyl-2-[1'-(2-methoxyacetyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide?
N-cyclopropyl-2-[1'-(2-methoxyacetyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide has a molecular weight of 356.47 g/mol, XLogP of 2.35, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[1'-(2-methoxyacetyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide is sourced from PubChem (CID 118741226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).