1-(2,3-dihydro-1H-inden-5-yl)-2-(furan-2-ylmethylamino)ethanone

C16H17NO2 — CID 82102295

IUPAC1-(2,3-dihydro-1H-inden-5-yl)-2-(furan-2-ylmethylamino)ethanone
SMILESO=C(CNCc1ccco1)c1ccc2c(c1)CCC2
InChIInChI=1S/C16H17NO2/c18-16(11-17-10-15-5-2-8-19-15)14-7-6-12-3-1-4-13(12)9-14/h2,5-9,17H,1,3-4,10-11H2
InChIKeyXHEXEGLJJVMVAF-UHFFFAOYSA-N
MW255.32 g/mol
LogP2.74
Rot. Bonds5

About 1-(2,3-dihydro-1H-inden-5-yl)-2-(furan-2-ylmethylamino)ethanone

1-(2,3-dihydro-1H-inden-5-yl)-2-(furan-2-ylmethylamino)ethanone (PubChem CID 82102295) has the molecular formula C16H17NO2 and a molecular weight of 255.32 g/mol. Its IUPAC name is 1-(2,3-dihydro-1H-inden-5-yl)-2-(furan-2-ylmethylamino)ethanone.

Molecular Properties

Compound Name1-(2,3-dihydro-1H-inden-5-yl)-2-(furan-2-ylmethylamino)ethanone
PubChem CID82102295
Molecular FormulaC16H17NO2
Molecular Weight255.32 g/mol
Exact Mass255.13
IUPAC Name1-(2,3-dihydro-1H-inden-5-yl)-2-(furan-2-ylmethylamino)ethanone
SMILESO=C(CNCc1ccco1)c1ccc2c(c1)CCC2
InChIInChI=1S/C16H17NO2/c18-16(11-17-10-15-5-2-8-19-15)14-7-6-12-3-1-4-13(12)9-14/h2,5-9,17H,1,3-4,10-11H2
InChIKeyXHEXEGLJJVMVAF-UHFFFAOYSA-N
XLogP2.74
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2,3-dihydro-1H-indol-5-yl)-2-(furan-2-ylmethylamino)ethanone
CID 82102355
1-(3,4-dihydro-2H-1,4-benzoxazin-6-yl)-2-(furan-2-ylmethylamino)ethanone
CID 82261175
1-(2,3-dihydro-1H-inden-5-yl)-2-(prop-2-enylamino)ethanone
CID 82102300
2-(2-hydroxyethylamino)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanone
CID 82101380
N-[2-(2,3-dihydro-1H-inden-5-yl)-2-oxoethyl]acetamide
CID 82113869
N-(2,3-dihydro-1H-inden-5-yl)-4-(furan-2-ylmethylsulfamoyl)benzamide
CID 26864849
2-(2,3-dihydro-1H-inden-5-yloxy)-N-(furan-2-ylmethyl)butanamide
CID 45148077
2-(2,3-dihydro-1H-inden-5-ylsulfanyl)-N-(furan-2-ylmethyl)-3-methylbutanamide
CID 112813149
N-(furan-2-ylmethyl)-2-[[2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetyl]amino]propanamide
CID 51096389
2-(hexylamino)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanone
CID 82101388
1-(2,3-dihydro-1H-inden-5-yl)-4-phenylbutane-1,4-dione
CID 90371119
N-cyclopentyl-2-(furan-2-ylmethylamino)acetamide
CID 28586516

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydro-1H-inden-5-yl)-2-(furan-2-ylmethylamino)ethanone?
The IUPAC name of 1-(2,3-dihydro-1H-inden-5-yl)-2-(furan-2-ylmethylamino)ethanone (CID 82102295) is 1-(2,3-dihydro-1H-inden-5-yl)-2-(furan-2-ylmethylamino)ethanone.
What is the SMILES notation for 1-(2,3-dihydro-1H-inden-5-yl)-2-(furan-2-ylmethylamino)ethanone?
The canonical SMILES for 1-(2,3-dihydro-1H-inden-5-yl)-2-(furan-2-ylmethylamino)ethanone is O=C(CNCc1ccco1)c1ccc2c(c1)CCC2.
What is the InChIKey of 1-(2,3-dihydro-1H-inden-5-yl)-2-(furan-2-ylmethylamino)ethanone?
The InChIKey is XHEXEGLJJVMVAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO2/c18-16(11-17-10-15-5-2-8-19-15)14-7-6-12-3-1-4-13(12)9-14/h2,5-9,17H,1,3-4,10-11H2.
What are the key properties of 1-(2,3-dihydro-1H-inden-5-yl)-2-(furan-2-ylmethylamino)ethanone?
1-(2,3-dihydro-1H-inden-5-yl)-2-(furan-2-ylmethylamino)ethanone has a molecular weight of 255.32 g/mol, XLogP of 2.74, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydro-1H-inden-5-yl)-2-(furan-2-ylmethylamino)ethanone is sourced from PubChem (CID 82102295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).