1-[1-(2,3-dihydro-1H-inden-5-yl)cyclopropyl]ethanone

C14H16O — CID 83686495

IUPAC1-[1-(2,3-dihydro-1H-inden-5-yl)cyclopropyl]ethanone
SMILESCC(=O)C1(c2ccc3c(c2)CCC3)CC1
InChIInChI=1S/C14H16O/c1-10(15)14(7-8-14)13-6-5-11-3-2-4-12(11)9-13/h5-6,9H,2-4,7-8H2,1H3
InChIKeyFUPVSXIEHPSWIV-UHFFFAOYSA-N
MW200.28 g/mol
LogP2.80
Rot. Bonds2

About 1-[1-(2,3-dihydro-1H-inden-5-yl)cyclopropyl]ethanone

1-[1-(2,3-dihydro-1H-inden-5-yl)cyclopropyl]ethanone (PubChem CID 83686495) has the molecular formula C14H16O and a molecular weight of 200.28 g/mol. Its IUPAC name is 1-[1-(2,3-dihydro-1H-inden-5-yl)cyclopropyl]ethanone.

Molecular Properties

Compound Name1-[1-(2,3-dihydro-1H-inden-5-yl)cyclopropyl]ethanone
PubChem CID83686495
Molecular FormulaC14H16O
Molecular Weight200.28 g/mol
Exact Mass200.12
IUPAC Name1-[1-(2,3-dihydro-1H-inden-5-yl)cyclopropyl]ethanone
SMILESCC(=O)C1(c2ccc3c(c2)CCC3)CC1
InChIInChI=1S/C14H16O/c1-10(15)14(7-8-14)13-6-5-11-3-2-4-12(11)9-13/h5-6,9H,2-4,7-8H2,1H3
InChIKeyFUPVSXIEHPSWIV-UHFFFAOYSA-N
XLogP2.80
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 52.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

methyl 1-(5,6,7,8-tetrahydronaphthalen-2-yl)cyclopropane-1-carboxylate
CID 116963958
1-(5,6,7,8-tetrahydronaphthalen-2-yl)cyclopentane-1-carboxylic acid
CID 117047079
2-(2,3-dihydro-1H-inden-5-yl)-2-methyl-1,3-dioxolane
CID 82126227
1-[1-(4-bromo-3-fluorophenyl)cyclopentyl]ethanone
CID 117046363
1-[1-(4-amino-3-fluorophenyl)cyclopentyl]ethanone
CID 117046703
1-[1-(3,5-dichlorophenyl)cyclopropyl]ethanone
CID 117046845
5-(2,3-dihydro-1H-inden-5-yl)-5-methyloxolan-2-one
CID 82113766
[1-(2,3-dihydro-1H-inden-5-yl)cyclobutyl]methanol
CID 83686763
1-[1-(3-phosphanylphenyl)cyclohexyl]ethanone
CID 144754940
N-(2,3-dihydro-1H-inden-5-yl)-N-methylacetamide
CID 115190982
ethane;1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanone
CID 123573357
1-[1-(3-fluoro-4-methoxyphenyl)cyclohexyl]ethanone
CID 82297467

Frequently Asked Questions

What is the IUPAC name of 1-[1-(2,3-dihydro-1H-inden-5-yl)cyclopropyl]ethanone?
The IUPAC name of 1-[1-(2,3-dihydro-1H-inden-5-yl)cyclopropyl]ethanone (CID 83686495) is 1-[1-(2,3-dihydro-1H-inden-5-yl)cyclopropyl]ethanone.
What is the SMILES notation for 1-[1-(2,3-dihydro-1H-inden-5-yl)cyclopropyl]ethanone?
The canonical SMILES for 1-[1-(2,3-dihydro-1H-inden-5-yl)cyclopropyl]ethanone is CC(=O)C1(c2ccc3c(c2)CCC3)CC1.
What is the InChIKey of 1-[1-(2,3-dihydro-1H-inden-5-yl)cyclopropyl]ethanone?
The InChIKey is FUPVSXIEHPSWIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16O/c1-10(15)14(7-8-14)13-6-5-11-3-2-4-12(11)9-13/h5-6,9H,2-4,7-8H2,1H3.
What are the key properties of 1-[1-(2,3-dihydro-1H-inden-5-yl)cyclopropyl]ethanone?
1-[1-(2,3-dihydro-1H-inden-5-yl)cyclopropyl]ethanone has a molecular weight of 200.28 g/mol, XLogP of 2.80, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(2,3-dihydro-1H-inden-5-yl)cyclopropyl]ethanone is sourced from PubChem (CID 83686495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).