2-(5-acetyl-2,3-dihydroindol-1-yl)-N-propylacetamide

C15H20N2O2 — CID 102662362

IUPAC2-(5-acetyl-2,3-dihydroindol-1-yl)-N-propylacetamide
SMILESCCCNC(=O)CN1CCc2cc(C(C)=O)ccc21
InChIInChI=1S/C15H20N2O2/c1-3-7-16-15(19)10-17-8-6-13-9-12(11(2)18)4-5-14(13)17/h4-5,9H,3,6-8,10H2,1-2H3,(H,16,19)
InChIKeyGFJACTWNGJREKH-UHFFFAOYSA-N
MW260.34 g/mol
LogP1.78
Rot. Bonds5

About 2-(5-acetyl-2,3-dihydroindol-1-yl)-N-propylacetamide

2-(5-acetyl-2,3-dihydroindol-1-yl)-N-propylacetamide (PubChem CID 102662362) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is 2-(5-acetyl-2,3-dihydroindol-1-yl)-N-propylacetamide.

Molecular Properties

Compound Name2-(5-acetyl-2,3-dihydroindol-1-yl)-N-propylacetamide
PubChem CID102662362
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC Name2-(5-acetyl-2,3-dihydroindol-1-yl)-N-propylacetamide
SMILESCCCNC(=O)CN1CCc2cc(C(C)=O)ccc21
InChIInChI=1S/C15H20N2O2/c1-3-7-16-15(19)10-17-8-6-13-9-12(11(2)18)4-5-14(13)17/h4-5,9H,3,6-8,10H2,1-2H3,(H,16,19)
InChIKeyGFJACTWNGJREKH-UHFFFAOYSA-N
XLogP1.78
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(5-acetyl-2,3-dihydroindol-1-yl)-N-cyclopropylacetamide
CID 102662276
1-(1-butyl-2,3-dihydroindol-5-yl)ethanone
CID 102662303
1-[1-(2-bromoprop-2-enyl)-2,3-dihydroindol-5-yl]ethanone
CID 102662312
3-(5-acetyl-2,3-dihydroindol-1-yl)-2-methylpropanoic acid
CID 82316589
ethane;1-(1-methyl-2,3-dihydroindol-5-yl)ethanone
CID 91428758
1-[1-(2-chloroprop-2-enyl)-3,4-dihydro-2H-quinolin-6-yl]ethanone
CID 102662516
1-[1-[(4-bromophenyl)methyl]-2,3-dihydroindol-5-yl]ethanone
CID 102662471
2-(6-acetyl-2-methyl-2,3-dihydro-1,4-benzoxazin-4-yl)-N-propylacetamide
CID 82025514
2-[5-(1-aminoethyl)-2,3-dihydroindol-1-yl]-N-(3-methylbutyl)acetamide
CID 102661516
N-ethyl-2-[5-[1-(ethylamino)ethyl]-2,3-dihydroindol-1-yl]acetamide
CID 102661757
1-[1-[(3,4-difluorophenyl)methyl]-2,3-dihydroindol-5-yl]ethanone
CID 102662248
1-[1-[(3-ethylimidazol-4-yl)methyl]-2,3-dihydroindol-5-yl]ethanone
CID 102662460

Frequently Asked Questions

What is the IUPAC name of 2-(5-acetyl-2,3-dihydroindol-1-yl)-N-propylacetamide?
The IUPAC name of 2-(5-acetyl-2,3-dihydroindol-1-yl)-N-propylacetamide (CID 102662362) is 2-(5-acetyl-2,3-dihydroindol-1-yl)-N-propylacetamide.
What is the SMILES notation for 2-(5-acetyl-2,3-dihydroindol-1-yl)-N-propylacetamide?
The canonical SMILES for 2-(5-acetyl-2,3-dihydroindol-1-yl)-N-propylacetamide is CCCNC(=O)CN1CCc2cc(C(C)=O)ccc21.
What is the InChIKey of 2-(5-acetyl-2,3-dihydroindol-1-yl)-N-propylacetamide?
The InChIKey is GFJACTWNGJREKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-3-7-16-15(19)10-17-8-6-13-9-12(11(2)18)4-5-14(13)17/h4-5,9H,3,6-8,10H2,1-2H3,(H,16,19).
What are the key properties of 2-(5-acetyl-2,3-dihydroindol-1-yl)-N-propylacetamide?
2-(5-acetyl-2,3-dihydroindol-1-yl)-N-propylacetamide has a molecular weight of 260.34 g/mol, XLogP of 1.78, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-acetyl-2,3-dihydroindol-1-yl)-N-propylacetamide is sourced from PubChem (CID 102662362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).