[2-[(1-acetyl-2,3-dihydroindol-5-yl)amino]-2-oxoethyl] 3-(furan-2-yl)propanoate

C19H20N2O5 — CID 30017533

IUPAC[2-[(1-acetyl-2,3-dihydroindol-5-yl)amino]-2-oxoethyl] 3-(furan-2-yl)propanoate
SMILESCC(=O)N1CCc2cc(NC(=O)COC(=O)CCc3ccco3)ccc21
InChIInChI=1S/C19H20N2O5/c1-13(22)21-9-8-14-11-15(4-6-17(14)21)20-18(23)12-26-19(24)7-5-16-3-2-10-25-16/h2-4,6,10-11H,5,7-9,12H2,1H3,(H,20,23)
InChIKeySIRVIWPTPMGFAX-UHFFFAOYSA-N
MW356.38 g/mol
LogP2.30
Rot. Bonds6

About [2-[(1-acetyl-2,3-dihydroindol-5-yl)amino]-2-oxoethyl] 3-(furan-2-yl)propanoate

[2-[(1-acetyl-2,3-dihydroindol-5-yl)amino]-2-oxoethyl] 3-(furan-2-yl)propanoate (PubChem CID 30017533) has the molecular formula C19H20N2O5 and a molecular weight of 356.38 g/mol. Its IUPAC name is [2-[(1-acetyl-2,3-dihydroindol-5-yl)amino]-2-oxoethyl] 3-(furan-2-yl)propanoate.

Molecular Properties

Compound Name[2-[(1-acetyl-2,3-dihydroindol-5-yl)amino]-2-oxoethyl] 3-(furan-2-yl)propanoate
PubChem CID30017533
Molecular FormulaC19H20N2O5
Molecular Weight356.38 g/mol
Exact Mass356.14
IUPAC Name[2-[(1-acetyl-2,3-dihydroindol-5-yl)amino]-2-oxoethyl] 3-(furan-2-yl)propanoate
SMILESCC(=O)N1CCc2cc(NC(=O)COC(=O)CCc3ccco3)ccc21
InChIInChI=1S/C19H20N2O5/c1-13(22)21-9-8-14-11-15(4-6-17(14)21)20-18(23)12-26-19(24)7-5-16-3-2-10-25-16/h2-4,6,10-11H,5,7-9,12H2,1H3,(H,20,23)
InChIKeySIRVIWPTPMGFAX-UHFFFAOYSA-N
XLogP2.30
TPSA88.85 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.38
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze [2-[(1-acetyl-2,3-dihydroindol-5-yl)amino]-2-oxoethyl] 3-(furan-2-yl)propanoate with MolForge

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Related Compounds

N-[3-[(1-acetyl-2,3-dihydroindol-5-yl)amino]-3-oxopropyl]furan-2-carboxamide
CID 78800817
[2-[(1-acetyl-2,3-dihydroindol-5-yl)amino]-2-oxoethyl] 2-hydroxybenzoate
CID 17463575
N-(1-acetyl-2,3-dihydroindol-5-yl)-2-(2-methoxyethoxy)acetamide
CID 103606736
N-(1-acetyl-2,3-dihydroindol-5-yl)-3-phenylpropanamide
CID 42424044
[2-[(1-acetyl-2,3-dihydroindol-5-yl)amino]-2-oxoethyl] 2-[3-(trifluoromethyl)phenoxy]acetate
CID 18272340
[2-[(1-acetyl-2,3-dihydroindol-5-yl)amino]-2-oxoethyl] 3-(hydroxymethyl)benzoate
CID 71884378
N-(1-acetyl-2,3-dihydroindol-5-yl)-2-bromoacetamide
CID 63679851
N-(1-acetyl-2,3-dihydroindol-5-yl)-4-aminobutanamide;hydrochloride
CID 119271758
N-(1-acetyl-2,3-dihydroindol-5-yl)pentanamide
CID 39952141
N-(1-acetyl-2,3-dihydroindol-5-yl)-1-(furan-2-ylmethyl)-5-oxopyrrolidine-3-carboxamide
CID 51189228
[2-(methylamino)-2-oxoethyl] 3-(furan-2-yl)propanoate
CID 78763973
N-(1-acetyl-2,3-dihydroindol-5-yl)-3-[5-(2-fluorophenyl)furan-2-yl]propanamide
CID 34184494

Frequently Asked Questions

What is the IUPAC name of [2-[(1-acetyl-2,3-dihydroindol-5-yl)amino]-2-oxoethyl] 3-(furan-2-yl)propanoate?
The IUPAC name of [2-[(1-acetyl-2,3-dihydroindol-5-yl)amino]-2-oxoethyl] 3-(furan-2-yl)propanoate (CID 30017533) is [2-[(1-acetyl-2,3-dihydroindol-5-yl)amino]-2-oxoethyl] 3-(furan-2-yl)propanoate.
What is the SMILES notation for [2-[(1-acetyl-2,3-dihydroindol-5-yl)amino]-2-oxoethyl] 3-(furan-2-yl)propanoate?
The canonical SMILES for [2-[(1-acetyl-2,3-dihydroindol-5-yl)amino]-2-oxoethyl] 3-(furan-2-yl)propanoate is CC(=O)N1CCc2cc(NC(=O)COC(=O)CCc3ccco3)ccc21.
What is the InChIKey of [2-[(1-acetyl-2,3-dihydroindol-5-yl)amino]-2-oxoethyl] 3-(furan-2-yl)propanoate?
The InChIKey is SIRVIWPTPMGFAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O5/c1-13(22)21-9-8-14-11-15(4-6-17(14)21)20-18(23)12-26-19(24)7-5-16-3-2-10-25-16/h2-4,6,10-11H,5,7-9,12H2,1H3,(H,20,23).
What are the key properties of [2-[(1-acetyl-2,3-dihydroindol-5-yl)amino]-2-oxoethyl] 3-(furan-2-yl)propanoate?
[2-[(1-acetyl-2,3-dihydroindol-5-yl)amino]-2-oxoethyl] 3-(furan-2-yl)propanoate has a molecular weight of 356.38 g/mol, XLogP of 2.30, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(1-acetyl-2,3-dihydroindol-5-yl)amino]-2-oxoethyl] 3-(furan-2-yl)propanoate is sourced from PubChem (CID 30017533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).