N-[1'-(2-hydroxyethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]-2-methoxyacetamide

C18H26N2O3 — CID 118744862

IUPACN-[1'-(2-hydroxyethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]-2-methoxyacetamide
SMILESCOCC(=O)NC1CC2(CCN(CCO)CC2)c2ccccc21
InChIInChI=1S/C18H26N2O3/c1-23-13-17(22)19-16-12-18(15-5-3-2-4-14(15)16)6-8-20(9-7-18)10-11-21/h2-5,16,21H,6-13H2,1H3,(H,19,22)
InChIKeyLDJHHJDNLWDKBP-UHFFFAOYSA-N
MW318.42 g/mol
LogP1.22
Rot. Bonds5

About N-[1'-(2-hydroxyethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]-2-methoxyacetamide

N-[1'-(2-hydroxyethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]-2-methoxyacetamide (PubChem CID 118744862) has the molecular formula C18H26N2O3 and a molecular weight of 318.42 g/mol. Its IUPAC name is N-[1'-(2-hydroxyethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]-2-methoxyacetamide.

Molecular Properties

Compound NameN-[1'-(2-hydroxyethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]-2-methoxyacetamide
PubChem CID118744862
Molecular FormulaC18H26N2O3
Molecular Weight318.42 g/mol
Exact Mass318.19
IUPAC NameN-[1'-(2-hydroxyethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]-2-methoxyacetamide
SMILESCOCC(=O)NC1CC2(CCN(CCO)CC2)c2ccccc21
InChIInChI=1S/C18H26N2O3/c1-23-13-17(22)19-16-12-18(15-5-3-2-4-14(15)16)6-8-20(9-7-18)10-11-21/h2-5,16,21H,6-13H2,1H3,(H,19,22)
InChIKeyLDJHHJDNLWDKBP-UHFFFAOYSA-N
XLogP1.22
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.42
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-Indanamine, N-(2-morpholinoacetyl)-
CID 110876
1-Indanamine, N-(2-morpholinopropionyl)-
CID 110879
N-(2,3-Dihydro-1H-inden-1-yl)-4-(morpholin-4-yl)butanimidic acid
CID 110883
1-Indanamine, N-(2-morpholinoacetyl)-2-phenyl-, hydrochloride
CID 115637
4-(Morpholin-4-yl)-N-(2-phenyl-2,3-dihydro-1H-inden-1-yl)butanimidic acid
CID 115639
3-(Morpholin-4-yl)-N-(2-phenyl-2,3-dihydro-1H-inden-1-yl)propanimidic acid
CID 115640
N-(2,3-dihydro-1H-inden-1-yl)-2-methoxy-N-methylacetamide
CID 53518519
N-{[1-(2,3-Dihydro-1H-inden-2-YL)piperidin-3-YL]methyl}-2-hydroxy-N-(2-methoxyethyl)acetamide
CID 72903729
2-Methoxy-1-(5-methyl-1-morpholin-4-ylspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl)ethanone
CID 118738948
N-[1'-[2-(dimethylamino)ethyl]spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]-2-methoxyacetamide
CID 118740898
N-cyclopropyl-2-[1'-(2-methoxyacetyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide
CID 118741226
2-[(5-Methylspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl)amino]ethanol
CID 118742134

Frequently Asked Questions

What is the IUPAC name of N-[1'-(2-hydroxyethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]-2-methoxyacetamide?
The IUPAC name of N-[1'-(2-hydroxyethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]-2-methoxyacetamide (CID 118744862) is N-[1'-(2-hydroxyethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]-2-methoxyacetamide.
What is the SMILES notation for N-[1'-(2-hydroxyethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]-2-methoxyacetamide?
The canonical SMILES for N-[1'-(2-hydroxyethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]-2-methoxyacetamide is COCC(=O)NC1CC2(CCN(CCO)CC2)c2ccccc21.
What is the InChIKey of N-[1'-(2-hydroxyethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]-2-methoxyacetamide?
The InChIKey is LDJHHJDNLWDKBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O3/c1-23-13-17(22)19-16-12-18(15-5-3-2-4-14(15)16)6-8-20(9-7-18)10-11-21/h2-5,16,21H,6-13H2,1H3,(H,19,22).
What are the key properties of N-[1'-(2-hydroxyethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]-2-methoxyacetamide?
N-[1'-(2-hydroxyethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]-2-methoxyacetamide has a molecular weight of 318.42 g/mol, XLogP of 1.22, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1'-(2-hydroxyethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]-2-methoxyacetamide is sourced from PubChem (CID 118744862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).