2-(2,3-dihydro-1H-inden-1-yl)-1-(1-oxa-8-azaspiro[4.5]decan-8-yl)ethanone

C19H25NO2 — CID 56873602

IUPAC2-(2,3-dihydro-1H-inden-1-yl)-1-(1-oxa-8-azaspiro[4.5]decan-8-yl)ethanone
SMILESO=C(CC1CCc2ccccc21)N1CCC2(CCCO2)CC1
InChIInChI=1S/C19H25NO2/c21-18(14-16-7-6-15-4-1-2-5-17(15)16)20-11-9-19(10-12-20)8-3-13-22-19/h1-2,4-5,16H,3,6-14H2
InChIKeyNDRIBYHSFSDDNS-UHFFFAOYSA-N
MW299.41 g/mol
LogP3.28
Rot. Bonds2

About 2-(2,3-dihydro-1H-inden-1-yl)-1-(1-oxa-8-azaspiro[4.5]decan-8-yl)ethanone

2-(2,3-dihydro-1H-inden-1-yl)-1-(1-oxa-8-azaspiro[4.5]decan-8-yl)ethanone (PubChem CID 56873602) has the molecular formula C19H25NO2 and a molecular weight of 299.41 g/mol. Its IUPAC name is 2-(2,3-dihydro-1H-inden-1-yl)-1-(1-oxa-8-azaspiro[4.5]decan-8-yl)ethanone.

Molecular Properties

Compound Name2-(2,3-dihydro-1H-inden-1-yl)-1-(1-oxa-8-azaspiro[4.5]decan-8-yl)ethanone
PubChem CID56873602
Molecular FormulaC19H25NO2
Molecular Weight299.41 g/mol
Exact Mass299.19
IUPAC Name2-(2,3-dihydro-1H-inden-1-yl)-1-(1-oxa-8-azaspiro[4.5]decan-8-yl)ethanone
SMILESO=C(CC1CCc2ccccc21)N1CCC2(CCCO2)CC1
InChIInChI=1S/C19H25NO2/c21-18(14-16-7-6-15-4-1-2-5-17(15)16)20-11-9-19(10-12-20)8-3-13-22-19/h1-2,4-5,16H,3,6-14H2
InChIKeyNDRIBYHSFSDDNS-UHFFFAOYSA-N
XLogP3.28
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.41
LogP ≤ 53.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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4-(3H-inden-1-yl)-1-morpholin-4-ylbutan-1-one
CID 46230958
Methanone, (2-indanyl)(4-morpholyl)-
CID 576078
1-[(2S,3aS,7aR)-2-methyl-3,3a,4,6,7,7a-hexahydro-2H-furo[3,2-c]pyridin-5-yl]-3-phenylpropan-1-one
CID 97367276
2-(2,3-dihydro-1H-inden-2-yl)-1-[5-(methoxymethyl)-3-oxa-9-azaspiro[5.5]undecan-9-yl]ethanone
CID 118739559
1-ethyl-4-(2-{[3-(methoxymethyl)-1-pyrrolidinyl]carbonyl}-2,3-dihydro-1H-inden-2-yl)piperazine
CID 45240403
[2-(4-ethylpiperazin-1-yl)-1,3-dihydroinden-2-yl]-[(3S)-3-(methoxymethyl)pyrrolidin-1-yl]methanone
CID 29002207
2-(oxolan-2-yl)-N-(spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-ylmethyl)acetamide
CID 71856718
(3-Ethylmorpholin-4-yl)-spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-ylmethanone
CID 71869729
[2-(Methoxymethyl)morpholin-4-yl]-spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-ylmethanone
CID 71869875
cyclopentyl-[(4S)-4-[(3-fluorophenyl)methyl]-1-oxa-9-azaspiro[5.5]undecan-9-yl]methanone
CID 164629740

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydro-1H-inden-1-yl)-1-(1-oxa-8-azaspiro[4.5]decan-8-yl)ethanone?
The IUPAC name of 2-(2,3-dihydro-1H-inden-1-yl)-1-(1-oxa-8-azaspiro[4.5]decan-8-yl)ethanone (CID 56873602) is 2-(2,3-dihydro-1H-inden-1-yl)-1-(1-oxa-8-azaspiro[4.5]decan-8-yl)ethanone.
What is the SMILES notation for 2-(2,3-dihydro-1H-inden-1-yl)-1-(1-oxa-8-azaspiro[4.5]decan-8-yl)ethanone?
The canonical SMILES for 2-(2,3-dihydro-1H-inden-1-yl)-1-(1-oxa-8-azaspiro[4.5]decan-8-yl)ethanone is O=C(CC1CCc2ccccc21)N1CCC2(CCCO2)CC1.
What is the InChIKey of 2-(2,3-dihydro-1H-inden-1-yl)-1-(1-oxa-8-azaspiro[4.5]decan-8-yl)ethanone?
The InChIKey is NDRIBYHSFSDDNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO2/c21-18(14-16-7-6-15-4-1-2-5-17(15)16)20-11-9-19(10-12-20)8-3-13-22-19/h1-2,4-5,16H,3,6-14H2.
What are the key properties of 2-(2,3-dihydro-1H-inden-1-yl)-1-(1-oxa-8-azaspiro[4.5]decan-8-yl)ethanone?
2-(2,3-dihydro-1H-inden-1-yl)-1-(1-oxa-8-azaspiro[4.5]decan-8-yl)ethanone has a molecular weight of 299.41 g/mol, XLogP of 3.28, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydro-1H-inden-1-yl)-1-(1-oxa-8-azaspiro[4.5]decan-8-yl)ethanone is sourced from PubChem (CID 56873602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).