1-[6-(morpholine-4-carbonyl)-2,3-dihydroindol-1-yl]ethanone

C15H18N2O3 — CID 53014605

IUPAC1-[6-(morpholine-4-carbonyl)-2,3-dihydroindol-1-yl]ethanone
SMILESCC(=O)N1CCc2ccc(C(=O)N3CCOCC3)cc21
InChIInChI=1S/C15H18N2O3/c1-11(18)17-5-4-12-2-3-13(10-14(12)17)15(19)16-6-8-20-9-7-16/h2-3,10H,4-9H2,1H3
InChIKeyHUFFEAREEMHSNL-UHFFFAOYSA-N
MW274.32 g/mol
LogP1.07
Rot. Bonds1

About 1-[6-(morpholine-4-carbonyl)-2,3-dihydroindol-1-yl]ethanone

1-[6-(morpholine-4-carbonyl)-2,3-dihydroindol-1-yl]ethanone (PubChem CID 53014605) has the molecular formula C15H18N2O3 and a molecular weight of 274.32 g/mol. Its IUPAC name is 1-[6-(morpholine-4-carbonyl)-2,3-dihydroindol-1-yl]ethanone.

Molecular Properties

Compound Name1-[6-(morpholine-4-carbonyl)-2,3-dihydroindol-1-yl]ethanone
PubChem CID53014605
Molecular FormulaC15H18N2O3
Molecular Weight274.32 g/mol
Exact Mass274.13
IUPAC Name1-[6-(morpholine-4-carbonyl)-2,3-dihydroindol-1-yl]ethanone
SMILESCC(=O)N1CCc2ccc(C(=O)N3CCOCC3)cc21
InChIInChI=1S/C15H18N2O3/c1-11(18)17-5-4-12-2-3-13(10-14(12)17)15(19)16-6-8-20-9-7-16/h2-3,10H,4-9H2,1H3
InChIKeyHUFFEAREEMHSNL-UHFFFAOYSA-N
XLogP1.07
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 51.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-[6-(morpholine-4-carbonyl)-2,3-dihydroindol-1-yl]propan-1-one
CID 53014611
1-[6-(4-methylpiperidine-1-carbonyl)-2,3-dihydroindol-1-yl]ethanone
CID 53014603
1-acetyl-2,3-dihydroindole-6-carboxylic acid
CID 82609550
1-[5-(4-phenylpiperazine-1-carbonyl)-2,3-dihydroindol-1-yl]ethanone
CID 29264486
1-(5-morpholin-4-yl-2,3-dihydroindol-1-yl)ethanone
CID 71684022
2,3-dihydro-1H-indol-6-yl(morpholin-4-yl)methanone
CID 90299623
(4-bromo-3-methylphenyl)-morpholin-4-ylmethanone
CID 18960596
2-(1-acetyl-2,3-dihydroindole-6-carbonyl)-8-methylidene-2,7-diazaspiro[4.5]decan-6-one
CID 158565667
1-acetyl-2,3-dihydroindole-6-carboxamide;2,2,2-trifluoroacetic acid
CID 172687576
2-methyl-1-[5-[4-(morpholine-4-carbonyl)phenyl]-2,3-dihydroindol-1-yl]propan-1-one
CID 53109904
(3S)-4-(1-acetyl-2,3-dihydroindole-5-carbonyl)morpholine-3-carboxylic acid
CID 125133422
1-[5-(4-cyclopentylpiperazine-1-carbonyl)-2,3-dihydroindol-1-yl]ethanone
CID 134020729

Frequently Asked Questions

What is the IUPAC name of 1-[6-(morpholine-4-carbonyl)-2,3-dihydroindol-1-yl]ethanone?
The IUPAC name of 1-[6-(morpholine-4-carbonyl)-2,3-dihydroindol-1-yl]ethanone (CID 53014605) is 1-[6-(morpholine-4-carbonyl)-2,3-dihydroindol-1-yl]ethanone.
What is the SMILES notation for 1-[6-(morpholine-4-carbonyl)-2,3-dihydroindol-1-yl]ethanone?
The canonical SMILES for 1-[6-(morpholine-4-carbonyl)-2,3-dihydroindol-1-yl]ethanone is CC(=O)N1CCc2ccc(C(=O)N3CCOCC3)cc21.
What is the InChIKey of 1-[6-(morpholine-4-carbonyl)-2,3-dihydroindol-1-yl]ethanone?
The InChIKey is HUFFEAREEMHSNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O3/c1-11(18)17-5-4-12-2-3-13(10-14(12)17)15(19)16-6-8-20-9-7-16/h2-3,10H,4-9H2,1H3.
What are the key properties of 1-[6-(morpholine-4-carbonyl)-2,3-dihydroindol-1-yl]ethanone?
1-[6-(morpholine-4-carbonyl)-2,3-dihydroindol-1-yl]ethanone has a molecular weight of 274.32 g/mol, XLogP of 1.07, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-(morpholine-4-carbonyl)-2,3-dihydroindol-1-yl]ethanone is sourced from PubChem (CID 53014605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).