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

C15H18O — CID 65420155

IUPAC2-(2,3-dihydro-1H-inden-5-yl)-1-(2-methylcyclopropyl)ethanone
SMILESCC1CC1C(=O)Cc1ccc2c(c1)CCC2
InChIInChI=1S/C15H18O/c1-10-7-14(10)15(16)9-11-5-6-12-3-2-4-13(12)8-11/h5-6,8,10,14H,2-4,7,9H2,1H3
InChIKeyCKYLSMQREOZERF-UHFFFAOYSA-N
MW214.31 g/mol
LogP2.94
Rot. Bonds3

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

2-(2,3-dihydro-1H-inden-5-yl)-1-(2-methylcyclopropyl)ethanone (PubChem CID 65420155) has the molecular formula C15H18O and a molecular weight of 214.31 g/mol. Its IUPAC name is 2-(2,3-dihydro-1H-inden-5-yl)-1-(2-methylcyclopropyl)ethanone.

Molecular Properties

Compound Name2-(2,3-dihydro-1H-inden-5-yl)-1-(2-methylcyclopropyl)ethanone
PubChem CID65420155
Molecular FormulaC15H18O
Molecular Weight214.31 g/mol
Exact Mass214.14
IUPAC Name2-(2,3-dihydro-1H-inden-5-yl)-1-(2-methylcyclopropyl)ethanone
SMILESCC1CC1C(=O)Cc1ccc2c(c1)CCC2
InChIInChI=1S/C15H18O/c1-10-7-14(10)15(16)9-11-5-6-12-3-2-4-13(12)8-11/h5-6,8,10,14H,2-4,7,9H2,1H3
InChIKeyCKYLSMQREOZERF-UHFFFAOYSA-N
XLogP2.94
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 52.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2,3-dihydro-1H-inden-5-yl)-1-(2-phenylcyclopropyl)ethanone
CID 114974399
1-cyclobutyl-2-(2,3-dihydro-1H-inden-5-yl)ethanone
CID 64982201
1-(7-azabicyclo[2.2.1]heptan-2-yl)-2-(2,3-dihydro-1H-inden-5-yl)ethanone
CID 116576079
2-(2,3-dihydro-1H-inden-5-yl)-1-(5,6-dimethyl-1,4-dithian-2-yl)ethanone
CID 103344954
2-(2,3-dihydro-1H-inden-5-yl)-N-(3-methylcyclopentyl)acetamide
CID 114549929
2-(2,3-dihydro-1H-inden-5-yl)-1-(thiolan-2-yl)ethanone
CID 80622050
N-cyclopropyl-2-(2,3-dihydro-1H-inden-5-yl)acetamide
CID 8623360
2-(2,3-dihydro-1H-inden-5-yl)-N-propan-2-ylacetamide
CID 60645732
(3S,4S)-1-[2-(2,3-dihydro-1H-inden-5-yl)acetyl]-3-methylpiperidine-4-carboxylic acid
CID 138032534
cis-(1R,3S)-3-[[2-(2,3-dihydro-1H-inden-5-yl)acetyl]amino]cyclopentane-1-carboxylic acid
CID 106320641
3-[[2-(2,3-dihydro-1H-inden-5-yl)acetyl]amino]cyclopentane-1-carboxylic acid
CID 66030527
2-(2,3-dihydro-1H-inden-5-yl)-1-(2-methylfuran-3-yl)ethanone
CID 113453266

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydro-1H-inden-5-yl)-1-(2-methylcyclopropyl)ethanone?
The IUPAC name of 2-(2,3-dihydro-1H-inden-5-yl)-1-(2-methylcyclopropyl)ethanone (CID 65420155) is 2-(2,3-dihydro-1H-inden-5-yl)-1-(2-methylcyclopropyl)ethanone.
What is the SMILES notation for 2-(2,3-dihydro-1H-inden-5-yl)-1-(2-methylcyclopropyl)ethanone?
The canonical SMILES for 2-(2,3-dihydro-1H-inden-5-yl)-1-(2-methylcyclopropyl)ethanone is CC1CC1C(=O)Cc1ccc2c(c1)CCC2.
What is the InChIKey of 2-(2,3-dihydro-1H-inden-5-yl)-1-(2-methylcyclopropyl)ethanone?
The InChIKey is CKYLSMQREOZERF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18O/c1-10-7-14(10)15(16)9-11-5-6-12-3-2-4-13(12)8-11/h5-6,8,10,14H,2-4,7,9H2,1H3.
What are the key properties of 2-(2,3-dihydro-1H-inden-5-yl)-1-(2-methylcyclopropyl)ethanone?
2-(2,3-dihydro-1H-inden-5-yl)-1-(2-methylcyclopropyl)ethanone has a molecular weight of 214.31 g/mol, XLogP of 2.94, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydro-1H-inden-5-yl)-1-(2-methylcyclopropyl)ethanone is sourced from PubChem (CID 65420155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).