1-cyclopropyl-2-(2,3-dihydroindol-1-yl)ethanone

C13H15NO — CID 63912554

IUPAC1-cyclopropyl-2-(2,3-dihydroindol-1-yl)ethanone
SMILESO=C(CN1CCc2ccccc21)C1CC1
InChIInChI=1S/C13H15NO/c15-13(11-5-6-11)9-14-8-7-10-3-1-2-4-12(10)14/h1-4,11H,5-9H2
InChIKeyNSUCIXOXLCWAAT-UHFFFAOYSA-N
MW201.27 g/mol
LogP2.03
Rot. Bonds3

About 1-cyclopropyl-2-(2,3-dihydroindol-1-yl)ethanone

1-cyclopropyl-2-(2,3-dihydroindol-1-yl)ethanone (PubChem CID 63912554) has the molecular formula C13H15NO and a molecular weight of 201.27 g/mol. Its IUPAC name is 1-cyclopropyl-2-(2,3-dihydroindol-1-yl)ethanone.

Molecular Properties

Compound Name1-cyclopropyl-2-(2,3-dihydroindol-1-yl)ethanone
PubChem CID63912554
Molecular FormulaC13H15NO
Molecular Weight201.27 g/mol
Exact Mass201.12
IUPAC Name1-cyclopropyl-2-(2,3-dihydroindol-1-yl)ethanone
SMILESO=C(CN1CCc2ccccc21)C1CC1
InChIInChI=1S/C13H15NO/c15-13(11-5-6-11)9-14-8-7-10-3-1-2-4-12(10)14/h1-4,11H,5-9H2
InChIKeyNSUCIXOXLCWAAT-UHFFFAOYSA-N
XLogP2.03
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 52.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2,3-dihydroindol-1-yl)acetate
CID 6935608
1-[2-(2,3-dihydroindol-1-yl)acetyl]pyrrolidine-3-carboxylic acid
CID 119353686
2-[[2-(2,3-dihydroindol-1-yl)acetyl]amino]acetic acid
CID 82041294
2-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)acetic acid
CID 54483331
2-(2,3-dihydroindol-1-yl)-N-phenylacetamide
CID 22199878
1-cyclopentyl-2-(2,3-dihydroindol-1-yl)ethanol
CID 104752368
1-(2-methylprop-2-enyl)-2,3-dihydroindole
CID 15723561
2-(3,4,5,6-tetrahydro-2H-1-benzazocin-1-yl)acetic acid
CID 119994270
N-(cyclopentylcarbamoyl)-2-(2,3-dihydroindol-1-yl)acetamide
CID 51170796
2-(3,4-dihydro-2H-quinolin-1-yl)-1-piperidin-2-ylethanone
CID 115006940
2,3-dihydroindol-1-ylmethylphosphonic acid
CID 53215241
cis-(1S,3R)-3-[2-(2,3-dihydroindol-1-yl)ethylcarbamoyl]cyclopentane-1-carboxylic acid
CID 133134060

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-2-(2,3-dihydroindol-1-yl)ethanone?
The IUPAC name of 1-cyclopropyl-2-(2,3-dihydroindol-1-yl)ethanone (CID 63912554) is 1-cyclopropyl-2-(2,3-dihydroindol-1-yl)ethanone.
What is the SMILES notation for 1-cyclopropyl-2-(2,3-dihydroindol-1-yl)ethanone?
The canonical SMILES for 1-cyclopropyl-2-(2,3-dihydroindol-1-yl)ethanone is O=C(CN1CCc2ccccc21)C1CC1.
What is the InChIKey of 1-cyclopropyl-2-(2,3-dihydroindol-1-yl)ethanone?
The InChIKey is NSUCIXOXLCWAAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NO/c15-13(11-5-6-11)9-14-8-7-10-3-1-2-4-12(10)14/h1-4,11H,5-9H2.
What are the key properties of 1-cyclopropyl-2-(2,3-dihydroindol-1-yl)ethanone?
1-cyclopropyl-2-(2,3-dihydroindol-1-yl)ethanone has a molecular weight of 201.27 g/mol, XLogP of 2.03, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-2-(2,3-dihydroindol-1-yl)ethanone is sourced from PubChem (CID 63912554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).