2-amino-1'-ethylspiro[1,2-dihydroindene-3,4'-pyrrolidine]-2'-one

C14H18N2O — CID 12525699

IUPAC2-amino-1'-ethylspiro[1,2-dihydroindene-3,4'-pyrrolidine]-2'-one
SMILESCCN1CC2(CC1=O)c1ccccc1CC2N
InChIInChI=1S/C14H18N2O/c1-2-16-9-14(8-13(16)17)11-6-4-3-5-10(11)7-12(14)15/h3-6,12H,2,7-9,15H2,1H3
InChIKeyQAKQSIGIIVFHTN-UHFFFAOYSA-N
MW230.31 g/mol
LogP1.06
Rot. Bonds1

About 2-amino-1'-ethylspiro[1,2-dihydroindene-3,4'-pyrrolidine]-2'-one

2-amino-1'-ethylspiro[1,2-dihydroindene-3,4'-pyrrolidine]-2'-one (PubChem CID 12525699) has the molecular formula C14H18N2O and a molecular weight of 230.31 g/mol. Its IUPAC name is 2-amino-1'-ethylspiro[1,2-dihydroindene-3,4'-pyrrolidine]-2'-one.

Molecular Properties

Compound Name2-amino-1'-ethylspiro[1,2-dihydroindene-3,4'-pyrrolidine]-2'-one
PubChem CID12525699
Molecular FormulaC14H18N2O
Molecular Weight230.31 g/mol
Exact Mass230.14
IUPAC Name2-amino-1'-ethylspiro[1,2-dihydroindene-3,4'-pyrrolidine]-2'-one
SMILESCCN1CC2(CC1=O)c1ccccc1CC2N
InChIInChI=1S/C14H18N2O/c1-2-16-9-14(8-13(16)17)11-6-4-3-5-10(11)7-12(14)15/h3-6,12H,2,7-9,15H2,1H3
InChIKeyQAKQSIGIIVFHTN-UHFFFAOYSA-N
XLogP1.06
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

8-[(1S)-2,3-dihydro-1H-indene-1-carbonyl]-2-ethyl-2,8-diazaspiro[4.5]decan-3-one
CID 95885398
spiro[1,2-dihydroindene-3,2'-1,3-dioxetane]-2-amine
CID 123819052
(2R,3R)-3-amino-2-ethyl-3,4-dihydro-1H-naphthalen-2-ol
CID 89278768
spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-amine;hydrochloride
CID 71756685
5-ethylspiro[3,6-dihydro-1H-1,5-benzodiazocine-2,4'-piperidine]-4-one
CID 155982691
8-amino-2-(2-phenoxyethyl)-2-azaspiro[4.5]decan-3-one
CID 177341131
8-(1,1-dioxo-3,4-dihydro-2H-1λ6,2-benzothiazine-3-carbonyl)-2-ethyl-2,8-diazaspiro[4.5]decan-3-one
CID 70753899
1-ethyl-10-methyl-10-azatricyclo[7.2.1.02,7]dodeca-2,4,6-triene
CID 45094601
1-amino-1,2,5,9b-tetrahydropyrrolo[2,1-a]isoindol-3-one
CID 83817792
5-ethylspiro[3,6-dihydro-1H-1,5-benzodiazocine-2,4'-piperidine]-4-one;dihydrochloride
CID 171687873
(1S,9R,10R,12S)-12-methyl-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2,4,6-trien-13-one
CID 54005917
2-N,2-N-dimethyl-1-propyl-2,3-dihydroindene-1,2-diamine
CID 43830978

Frequently Asked Questions

What is the IUPAC name of 2-amino-1'-ethylspiro[1,2-dihydroindene-3,4'-pyrrolidine]-2'-one?
The IUPAC name of 2-amino-1'-ethylspiro[1,2-dihydroindene-3,4'-pyrrolidine]-2'-one (CID 12525699) is 2-amino-1'-ethylspiro[1,2-dihydroindene-3,4'-pyrrolidine]-2'-one.
What is the SMILES notation for 2-amino-1'-ethylspiro[1,2-dihydroindene-3,4'-pyrrolidine]-2'-one?
The canonical SMILES for 2-amino-1'-ethylspiro[1,2-dihydroindene-3,4'-pyrrolidine]-2'-one is CCN1CC2(CC1=O)c1ccccc1CC2N.
What is the InChIKey of 2-amino-1'-ethylspiro[1,2-dihydroindene-3,4'-pyrrolidine]-2'-one?
The InChIKey is QAKQSIGIIVFHTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O/c1-2-16-9-14(8-13(16)17)11-6-4-3-5-10(11)7-12(14)15/h3-6,12H,2,7-9,15H2,1H3.
What are the key properties of 2-amino-1'-ethylspiro[1,2-dihydroindene-3,4'-pyrrolidine]-2'-one?
2-amino-1'-ethylspiro[1,2-dihydroindene-3,4'-pyrrolidine]-2'-one has a molecular weight of 230.31 g/mol, XLogP of 1.06, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1'-ethylspiro[1,2-dihydroindene-3,4'-pyrrolidine]-2'-one is sourced from PubChem (CID 12525699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).