N,N-dimethyl-1-(morpholine-4-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1'-carboxamide

C21H29N3O3 — CID 131643150

IUPACN,N-dimethyl-1-(morpholine-4-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1'-carboxamide
SMILESCN(C)C(=O)N1CCC2(CC1)CC(C(=O)N1CCOCC1)c1ccccc12
InChIInChI=1S/C21H29N3O3/c1-22(2)20(26)24-9-7-21(8-10-24)15-17(16-5-3-4-6-18(16)21)19(25)23-11-13-27-14-12-23/h3-6,17H,7-15H2,1-2H3
InChIKeyJYWQVKOBZYSBMA-UHFFFAOYSA-N
MW371.48 g/mol
LogP2.05
Rot. Bonds1

About N,N-dimethyl-1-(morpholine-4-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1'-carboxamide

N,N-dimethyl-1-(morpholine-4-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1'-carboxamide (PubChem CID 131643150) has the molecular formula C21H29N3O3 and a molecular weight of 371.48 g/mol. Its IUPAC name is N,N-dimethyl-1-(morpholine-4-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1'-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-1-(morpholine-4-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1'-carboxamide
PubChem CID131643150
Molecular FormulaC21H29N3O3
Molecular Weight371.48 g/mol
Exact Mass371.22
IUPAC NameN,N-dimethyl-1-(morpholine-4-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1'-carboxamide
SMILESCN(C)C(=O)N1CCC2(CC1)CC(C(=O)N1CCOCC1)c1ccccc12
InChIInChI=1S/C21H29N3O3/c1-22(2)20(26)24-9-7-21(8-10-24)15-17(16-5-3-4-6-18(16)21)19(25)23-11-13-27-14-12-23/h3-6,17H,7-15H2,1-2H3
InChIKeyJYWQVKOBZYSBMA-UHFFFAOYSA-N
XLogP2.05
TPSA53.09 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.48
LogP ≤ 52.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-(morpholine-4-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1'-carboxamide?
The IUPAC name of N,N-dimethyl-1-(morpholine-4-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1'-carboxamide (CID 131643150) is N,N-dimethyl-1-(morpholine-4-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1'-carboxamide.
What is the SMILES notation for N,N-dimethyl-1-(morpholine-4-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1'-carboxamide?
The canonical SMILES for N,N-dimethyl-1-(morpholine-4-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1'-carboxamide is CN(C)C(=O)N1CCC2(CC1)CC(C(=O)N1CCOCC1)c1ccccc12.
What is the InChIKey of N,N-dimethyl-1-(morpholine-4-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1'-carboxamide?
The InChIKey is JYWQVKOBZYSBMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H29N3O3/c1-22(2)20(26)24-9-7-21(8-10-24)15-17(16-5-3-4-6-18(16)21)19(25)23-11-13-27-14-12-23/h3-6,17H,7-15H2,1-2H3.
What are the key properties of N,N-dimethyl-1-(morpholine-4-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1'-carboxamide?
N,N-dimethyl-1-(morpholine-4-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1'-carboxamide has a molecular weight of 371.48 g/mol, XLogP of 2.05, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-(morpholine-4-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1'-carboxamide is sourced from PubChem (CID 131643150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).