6'-hydroxy-1'-prop-2-enylspiro[3H-indene-2,3'-piperidine]-1,2'-dione

C16H17NO3 — CID 134847830

IUPAC6'-hydroxy-1'-prop-2-enylspiro[3H-indene-2,3'-piperidine]-1,2'-dione
SMILESC=CCN1C(=O)C2(CCC1O)Cc1ccccc1C2=O
InChIInChI=1S/C16H17NO3/c1-2-9-17-13(18)7-8-16(15(17)20)10-11-5-3-4-6-12(11)14(16)19/h2-6,13,18H,1,7-10H2
InChIKeyKUUSSPPFDMSEHF-UHFFFAOYSA-N
MW271.32 g/mol
LogP1.54
Rot. Bonds2

About 6'-hydroxy-1'-prop-2-enylspiro[3H-indene-2,3'-piperidine]-1,2'-dione

6'-hydroxy-1'-prop-2-enylspiro[3H-indene-2,3'-piperidine]-1,2'-dione (PubChem CID 134847830) has the molecular formula C16H17NO3 and a molecular weight of 271.32 g/mol. Its IUPAC name is 6'-hydroxy-1'-prop-2-enylspiro[3H-indene-2,3'-piperidine]-1,2'-dione.

Molecular Properties

Compound Name6'-hydroxy-1'-prop-2-enylspiro[3H-indene-2,3'-piperidine]-1,2'-dione
PubChem CID134847830
Molecular FormulaC16H17NO3
Molecular Weight271.32 g/mol
Exact Mass271.12
IUPAC Name6'-hydroxy-1'-prop-2-enylspiro[3H-indene-2,3'-piperidine]-1,2'-dione
SMILESC=CCN1C(=O)C2(CCC1O)Cc1ccccc1C2=O
InChIInChI=1S/C16H17NO3/c1-2-9-17-13(18)7-8-16(15(17)20)10-11-5-3-4-6-12(11)14(16)19/h2-6,13,18H,1,7-10H2
InChIKeyKUUSSPPFDMSEHF-UHFFFAOYSA-N
XLogP1.54
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

1-oxo-2-prop-2-enyl-3,4-dihydroisoquinoline-3-carboxylic acid
CID 82363873
(2R)-2-hydroxy-2-prop-2-enyl-3,4-dihydronaphthalen-1-one
CID 100988945
(2S)-2-hydroxy-2-[(1S)-1-phenylprop-2-enyl]-3H-inden-1-one
CID 134962891
(2S)-2-hydroxy-2-[(1R)-1-phenylprop-2-enyl]-3H-inden-1-one
CID 134962581
spiro[3H-indene-2,3'-piperidine]-1,2'-dione
CID 121207629
(2S)-2-methyl-2-prop-2-enyl-3,4-dihydronaphthalen-1-one
CID 45096682
(2S)-2-cyclopentyl-2-(hydroxymethyl)-3H-inden-1-one
CID 90923684
2-(bromomethyl)-2-but-3-enyl-3H-inden-1-one
CID 25023064
2-prop-2-enyl-4H-isoquinoline-1,3-dione
CID 58158111
3-(2-oxo-3,4-dihydro-1H-naphthalen-1-yl)-2-prop-2-enyl-3H-isoindol-1-one
CID 132533577
4,5-diphenyl-1-prop-2-enylimidazolidin-2-one
CID 67652327
2,2-bis(trifluoromethyl)-3H-inden-1-one
CID 10015841

Frequently Asked Questions

What is the IUPAC name of 6'-hydroxy-1'-prop-2-enylspiro[3H-indene-2,3'-piperidine]-1,2'-dione?
The IUPAC name of 6'-hydroxy-1'-prop-2-enylspiro[3H-indene-2,3'-piperidine]-1,2'-dione (CID 134847830) is 6'-hydroxy-1'-prop-2-enylspiro[3H-indene-2,3'-piperidine]-1,2'-dione.
What is the SMILES notation for 6'-hydroxy-1'-prop-2-enylspiro[3H-indene-2,3'-piperidine]-1,2'-dione?
The canonical SMILES for 6'-hydroxy-1'-prop-2-enylspiro[3H-indene-2,3'-piperidine]-1,2'-dione is C=CCN1C(=O)C2(CCC1O)Cc1ccccc1C2=O.
What is the InChIKey of 6'-hydroxy-1'-prop-2-enylspiro[3H-indene-2,3'-piperidine]-1,2'-dione?
The InChIKey is KUUSSPPFDMSEHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO3/c1-2-9-17-13(18)7-8-16(15(17)20)10-11-5-3-4-6-12(11)14(16)19/h2-6,13,18H,1,7-10H2.
What are the key properties of 6'-hydroxy-1'-prop-2-enylspiro[3H-indene-2,3'-piperidine]-1,2'-dione?
6'-hydroxy-1'-prop-2-enylspiro[3H-indene-2,3'-piperidine]-1,2'-dione has a molecular weight of 271.32 g/mol, XLogP of 1.54, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6'-hydroxy-1'-prop-2-enylspiro[3H-indene-2,3'-piperidine]-1,2'-dione is sourced from PubChem (CID 134847830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).