1-(1-methyl-2,3-dihydroinden-1-yl)piperidine;N-methyl-2-(3-methyl-2-oxo-1H-indol-3-yl)acetamide

C27H35N3O2 — CID 144663004

IUPAC1-(1-methyl-2,3-dihydroinden-1-yl)piperidine;N-methyl-2-(3-methyl-2-oxo-1H-indol-3-yl)acetamide
SMILESCC1(N2CCCCC2)CCc2ccccc21.CNC(=O)CC1(C)C(=O)Nc2ccccc21
InChIInChI=1S/C15H21N.C12H14N2O2/c1-15(16-11-5-2-6-12-16)10-9-13-7-3-4-8-14(13)15;1-12(7-10(15)13-2)8-5-3-4-6-9(8)14-11(12)16/h3-4,7-8H,2,5-6,9-12H2,1H3;3-6H,7H2,1-2H3,(H,13,15)(H,14,16)
InChIKeyPICKXDGWBIBELA-UHFFFAOYSA-N
MW433.60 g/mol
LogP4.37
Rot. Bonds3

About 1-(1-methyl-2,3-dihydroinden-1-yl)piperidine;N-methyl-2-(3-methyl-2-oxo-1H-indol-3-yl)acetamide

1-(1-methyl-2,3-dihydroinden-1-yl)piperidine;N-methyl-2-(3-methyl-2-oxo-1H-indol-3-yl)acetamide (PubChem CID 144663004) has the molecular formula C27H35N3O2 and a molecular weight of 433.60 g/mol. Its IUPAC name is 1-(1-methyl-2,3-dihydroinden-1-yl)piperidine;N-methyl-2-(3-methyl-2-oxo-1H-indol-3-yl)acetamide.

Molecular Properties

Compound Name1-(1-methyl-2,3-dihydroinden-1-yl)piperidine;N-methyl-2-(3-methyl-2-oxo-1H-indol-3-yl)acetamide
PubChem CID144663004
Molecular FormulaC27H35N3O2
Molecular Weight433.60 g/mol
Exact Mass433.27
IUPAC Name1-(1-methyl-2,3-dihydroinden-1-yl)piperidine;N-methyl-2-(3-methyl-2-oxo-1H-indol-3-yl)acetamide
SMILESCC1(N2CCCCC2)CCc2ccccc21.CNC(=O)CC1(C)C(=O)Nc2ccccc21
InChIInChI=1S/C15H21N.C12H14N2O2/c1-15(16-11-5-2-6-12-16)10-9-13-7-3-4-8-14(13)15;1-12(7-10(15)13-2)8-5-3-4-6-9(8)14-11(12)16/h3-4,7-8H,2,5-6,9-12H2,1H3;3-6H,7H2,1-2H3,(H,13,15)(H,14,16)
InChIKeyPICKXDGWBIBELA-UHFFFAOYSA-N
XLogP4.37
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500433.60
LogP ≤ 54.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-2-[(3R)-3-methyl-1-[1-[(1S)-1-methyl-3,4-dihydro-2H-naphthalen-1-yl]piperidin-4-yl]-2-oxoindol-3-yl]acetamide
CID 86304160
2-[3-hydroxy-1-[1-(1-methyl-3,4-dihydro-2H-naphthalen-1-yl)piperidin-4-yl]-2-oxoindol-3-yl]-N-methylacetamide
CID 75593274
N-methyl-2-[(3R)-3-methyl-2-sulfanylidene-1H-indol-3-yl]acetamide
CID 125489947
methyl 2-[3-methyl-1-[1-(1-methyl-2,3-dihydroinden-1-yl)piperidin-4-yl]-2-oxoindol-3-yl]acetate
CID 118529027
methyl 2-[3-methyl-1-[1-(1-methyl-3,4-dihydro-2H-naphthalen-1-yl)piperidin-4-yl]-2-oxoindol-3-yl]acetate
CID 90259594
N-methyl-2-[(3R)-3-methyl-1-[1-[(1S)-1-methyl-2H-acenaphthylen-1-yl]piperidin-4-yl]-2-oxoindol-3-yl]acetamide
CID 90270623
2-[(3S)-2',5'-dioxospiro[1,2-dihydroindene-3,3'-pyrrolidine]-1'-yl]-N-methylacetamide
CID 99820044
2-[(3S)-1-[1-[(1S,2S)-2-hydroxy-1,2,3,4-tetrahydronaphthalen-1-yl]piperidin-4-yl]-3-methyl-2-oxoindol-3-yl]-N-methylacetamide
CID 86304974
2-[(3R)-1-[1-[(1S,2S)-2-hydroxy-1,2,3,4-tetrahydronaphthalen-1-yl]piperidin-4-yl]-3-methyl-2-oxoindol-3-yl]-N-methylacetamide
CID 86304973
N-methyl-2-[(3S)-3-methyl-1-[3-[[(1S)-1-methyl-2,3-dihydroinden-1-yl]-propylamino]propyl]-2-oxoindol-3-yl]acetamide
CID 144662972
(1-propan-2-yl-2,3-dihydroinden-1-yl) piperidine-1-carboxylate
CID 170530209
9b-methyl-1,2,3,5-tetrahydropyrrolo[2,1-a]isoindole;ethane
CID 176714450

Frequently Asked Questions

What is the IUPAC name of 1-(1-methyl-2,3-dihydroinden-1-yl)piperidine;N-methyl-2-(3-methyl-2-oxo-1H-indol-3-yl)acetamide?
The IUPAC name of 1-(1-methyl-2,3-dihydroinden-1-yl)piperidine;N-methyl-2-(3-methyl-2-oxo-1H-indol-3-yl)acetamide (CID 144663004) is 1-(1-methyl-2,3-dihydroinden-1-yl)piperidine;N-methyl-2-(3-methyl-2-oxo-1H-indol-3-yl)acetamide.
What is the SMILES notation for 1-(1-methyl-2,3-dihydroinden-1-yl)piperidine;N-methyl-2-(3-methyl-2-oxo-1H-indol-3-yl)acetamide?
The canonical SMILES for 1-(1-methyl-2,3-dihydroinden-1-yl)piperidine;N-methyl-2-(3-methyl-2-oxo-1H-indol-3-yl)acetamide is CC1(N2CCCCC2)CCc2ccccc21.CNC(=O)CC1(C)C(=O)Nc2ccccc21.
What is the InChIKey of 1-(1-methyl-2,3-dihydroinden-1-yl)piperidine;N-methyl-2-(3-methyl-2-oxo-1H-indol-3-yl)acetamide?
The InChIKey is PICKXDGWBIBELA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N.C12H14N2O2/c1-15(16-11-5-2-6-12-16)10-9-13-7-3-4-8-14(13)15;1-12(7-10(15)13-2)8-5-3-4-6-9(8)14-11(12)16/h3-4,7-8H,2,5-6,9-12H2,1H3;3-6H,7H2,1-2H3,(H,13,15)(H,14,16).
What are the key properties of 1-(1-methyl-2,3-dihydroinden-1-yl)piperidine;N-methyl-2-(3-methyl-2-oxo-1H-indol-3-yl)acetamide?
1-(1-methyl-2,3-dihydroinden-1-yl)piperidine;N-methyl-2-(3-methyl-2-oxo-1H-indol-3-yl)acetamide has a molecular weight of 433.60 g/mol, XLogP of 4.37, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methyl-2,3-dihydroinden-1-yl)piperidine;N-methyl-2-(3-methyl-2-oxo-1H-indol-3-yl)acetamide is sourced from PubChem (CID 144663004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).