(2-hydroxyspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl)-[5-(morpholin-4-ylmethyl)furan-3-yl]methanone

C23H28N2O4 — CID 74246609

IUPAC(2-hydroxyspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl)-[5-(morpholin-4-ylmethyl)furan-3-yl]methanone
SMILESO=C(c1coc(CN2CCOCC2)c1)N1CCC2(CC1)c1ccccc1CC2O
InChIInChI=1S/C23H28N2O4/c26-21-14-17-3-1-2-4-20(17)23(21)5-7-25(8-6-23)22(27)18-13-19(29-16-18)15-24-9-11-28-12-10-24/h1-4,13,16,21,26H,5-12,14-15H2
InChIKeyWNGIHPIZCBDXJO-UHFFFAOYSA-N
MW396.49 g/mol
LogP2.20
Rot. Bonds3

About (2-hydroxyspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl)-[5-(morpholin-4-ylmethyl)furan-3-yl]methanone

(2-hydroxyspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl)-[5-(morpholin-4-ylmethyl)furan-3-yl]methanone (PubChem CID 74246609) has the molecular formula C23H28N2O4 and a molecular weight of 396.49 g/mol. Its IUPAC name is (2-hydroxyspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl)-[5-(morpholin-4-ylmethyl)furan-3-yl]methanone.

Molecular Properties

Compound Name(2-hydroxyspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl)-[5-(morpholin-4-ylmethyl)furan-3-yl]methanone
PubChem CID74246609
Molecular FormulaC23H28N2O4
Molecular Weight396.49 g/mol
Exact Mass396.20
IUPAC Name(2-hydroxyspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl)-[5-(morpholin-4-ylmethyl)furan-3-yl]methanone
SMILESO=C(c1coc(CN2CCOCC2)c1)N1CCC2(CC1)c1ccccc1CC2O
InChIInChI=1S/C23H28N2O4/c26-21-14-17-3-1-2-4-20(17)23(21)5-7-25(8-6-23)22(27)18-13-19(29-16-18)15-24-9-11-28-12-10-24/h1-4,13,16,21,26H,5-12,14-15H2
InChIKeyWNGIHPIZCBDXJO-UHFFFAOYSA-N
XLogP2.20
TPSA66.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.49
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1'-[(3-morpholin-4-ylphenyl)methyl]spiro[1,2-dihydroindene-3,4'-piperidine]-2-ol
CID 56897611
9-[5-(morpholin-4-ylmethyl)furan-3-carbonyl]-1-oxa-3,9-diazaspiro[4.6]undecan-2-one
CID 56901941
(2R)-1'-[(5-methylfuran-2-yl)methyl]spiro[1,2-dihydroindene-3,4'-piperidine]-2-ol
CID 95725868
[(2S)-2-hydroxyspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl]-(3-methylimidazo[4,5-b]pyridin-6-yl)methanone
CID 95726170
6-(2-hydroxyspiro[1,2-dihydroindene-3,4'-piperidine]-1'-carbonyl)-1,3-dimethylpyrimidine-2,4-dione
CID 72920747
(4-fluoro-3-methoxyphenyl)-(2-hydroxyspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl)methanone
CID 56891399
[(1S,6R)-9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl]-[5-(morpholin-4-ylmethyl)furan-3-yl]methanone
CID 133118050
[(2S)-2-hydroxyspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl]-[4-(1H-pyrazol-5-yl)phenyl]methanone
CID 95730053
(E)-1-(2-hydroxyspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl)pent-3-en-1-one
CID 56889620
N-[[(3S)-3,4-dihydro-2H-chromen-3-yl]methyl]-5-(morpholin-4-ylmethyl)furan-3-carboxamide
CID 97150277
[(2S)-2-hydroxyspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl]-(5-propyl-1,2-oxazol-4-yl)methanone
CID 95723009
2-[(3R)-1'-benzoylspiro[3,4-dihydroisochromene-1,4'-piperidine]-3-yl]-1-morpholin-4-ylethanone
CID 164632379

Frequently Asked Questions

What is the IUPAC name of (2-hydroxyspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl)-[5-(morpholin-4-ylmethyl)furan-3-yl]methanone?
The IUPAC name of (2-hydroxyspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl)-[5-(morpholin-4-ylmethyl)furan-3-yl]methanone (CID 74246609) is (2-hydroxyspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl)-[5-(morpholin-4-ylmethyl)furan-3-yl]methanone.
What is the SMILES notation for (2-hydroxyspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl)-[5-(morpholin-4-ylmethyl)furan-3-yl]methanone?
The canonical SMILES for (2-hydroxyspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl)-[5-(morpholin-4-ylmethyl)furan-3-yl]methanone is O=C(c1coc(CN2CCOCC2)c1)N1CCC2(CC1)c1ccccc1CC2O.
What is the InChIKey of (2-hydroxyspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl)-[5-(morpholin-4-ylmethyl)furan-3-yl]methanone?
The InChIKey is WNGIHPIZCBDXJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28N2O4/c26-21-14-17-3-1-2-4-20(17)23(21)5-7-25(8-6-23)22(27)18-13-19(29-16-18)15-24-9-11-28-12-10-24/h1-4,13,16,21,26H,5-12,14-15H2.
What are the key properties of (2-hydroxyspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl)-[5-(morpholin-4-ylmethyl)furan-3-yl]methanone?
(2-hydroxyspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl)-[5-(morpholin-4-ylmethyl)furan-3-yl]methanone has a molecular weight of 396.49 g/mol, XLogP of 2.20, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2-hydroxyspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl)-[5-(morpholin-4-ylmethyl)furan-3-yl]methanone is sourced from PubChem (CID 74246609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).