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

C16H20N2O3 — CID 53014611

IUPAC1-[6-(morpholine-4-carbonyl)-2,3-dihydroindol-1-yl]propan-1-one
SMILESCCC(=O)N1CCc2ccc(C(=O)N3CCOCC3)cc21
InChIInChI=1S/C16H20N2O3/c1-2-15(19)18-6-5-12-3-4-13(11-14(12)18)16(20)17-7-9-21-10-8-17/h3-4,11H,2,5-10H2,1H3
InChIKeyZUTTUGWQEKYHRP-UHFFFAOYSA-N
MW288.35 g/mol
LogP1.46
Rot. Bonds2

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

1-[6-(morpholine-4-carbonyl)-2,3-dihydroindol-1-yl]propan-1-one (PubChem CID 53014611) has the molecular formula C16H20N2O3 and a molecular weight of 288.35 g/mol. Its IUPAC name is 1-[6-(morpholine-4-carbonyl)-2,3-dihydroindol-1-yl]propan-1-one.

Molecular Properties

Compound Name1-[6-(morpholine-4-carbonyl)-2,3-dihydroindol-1-yl]propan-1-one
PubChem CID53014611
Molecular FormulaC16H20N2O3
Molecular Weight288.35 g/mol
Exact Mass288.15
IUPAC Name1-[6-(morpholine-4-carbonyl)-2,3-dihydroindol-1-yl]propan-1-one
SMILESCCC(=O)N1CCc2ccc(C(=O)N3CCOCC3)cc21
InChIInChI=1S/C16H20N2O3/c1-2-15(19)18-6-5-12-3-4-13(11-14(12)18)16(20)17-7-9-21-10-8-17/h3-4,11H,2,5-10H2,1H3
InChIKeyZUTTUGWQEKYHRP-UHFFFAOYSA-N
XLogP1.46
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 51.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-[6-(morpholine-4-carbonyl)-2,3-dihydroindol-1-yl]ethanone
CID 53014605
4-[4-[2-[6-(morpholine-4-carbonyl)-2,3-dihydroindol-1-yl]-2-oxoethyl]phenyl]-2H-phthalazin-1-one
CID 118556562
N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]-1-propanoyl-2,3-dihydroindole-5-carboxamide
CID 55789812
1-[5-(4-pyrrolidin-1-ylpiperidine-1-carbonyl)-2,3-dihydroindol-1-yl]propan-1-one
CID 55981657
N-cyclohexyl-1-propanoyl-2,3-dihydroindole-6-carboxamide
CID 53014606
1-[6-(4-methylpiperidine-1-carbonyl)-2,3-dihydroindol-1-yl]ethanone
CID 53014603
2-[4-(2,3-dihydroindole-1-carbonyl)-2-ethoxyphenoxy]-1-morpholin-4-ylethanone
CID 8012463
2,3-dihydro-1H-indol-6-yl(morpholin-4-yl)methanone
CID 90299623
1-[5-[3-(1-hydroxyethyl)pyrrolidine-1-carbonyl]-2,3-dihydroindol-1-yl]propan-1-one
CID 110023370
(4-bromo-3-methylphenyl)-morpholin-4-ylmethanone
CID 18960596
1-(2-methylsulfonylacetyl)-2,3-dihydroindole-6-carboxylic acid
CID 113382365
2-methyl-1-[5-[4-(morpholine-4-carbonyl)phenyl]-2,3-dihydroindol-1-yl]propan-1-one
CID 53109904

Frequently Asked Questions

What is the IUPAC name of 1-[6-(morpholine-4-carbonyl)-2,3-dihydroindol-1-yl]propan-1-one?
The IUPAC name of 1-[6-(morpholine-4-carbonyl)-2,3-dihydroindol-1-yl]propan-1-one (CID 53014611) is 1-[6-(morpholine-4-carbonyl)-2,3-dihydroindol-1-yl]propan-1-one.
What is the SMILES notation for 1-[6-(morpholine-4-carbonyl)-2,3-dihydroindol-1-yl]propan-1-one?
The canonical SMILES for 1-[6-(morpholine-4-carbonyl)-2,3-dihydroindol-1-yl]propan-1-one is CCC(=O)N1CCc2ccc(C(=O)N3CCOCC3)cc21.
What is the InChIKey of 1-[6-(morpholine-4-carbonyl)-2,3-dihydroindol-1-yl]propan-1-one?
The InChIKey is ZUTTUGWQEKYHRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O3/c1-2-15(19)18-6-5-12-3-4-13(11-14(12)18)16(20)17-7-9-21-10-8-17/h3-4,11H,2,5-10H2,1H3.
What are the key properties of 1-[6-(morpholine-4-carbonyl)-2,3-dihydroindol-1-yl]propan-1-one?
1-[6-(morpholine-4-carbonyl)-2,3-dihydroindol-1-yl]propan-1-one has a molecular weight of 288.35 g/mol, XLogP of 1.46, 2 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]propan-1-one is sourced from PubChem (CID 53014611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).