2,3-dihydroindol-1-yl(morpholin-4-yl)methanone

C13H16N2O2 — CID 669642

IUPAC2,3-dihydroindol-1-yl(morpholin-4-yl)methanone
SMILESO=C(N1CCOCC1)N1CCc2ccccc21
InChIInChI=1S/C13H16N2O2/c16-13(14-7-9-17-10-8-14)15-6-5-11-3-1-2-4-12(11)15/h1-4H,5-10H2
InChIKeyPCQMYNZGLUFJCE-UHFFFAOYSA-N
MW232.28 g/mol
LogP1.50
Rot. Bonds

About 2,3-dihydroindol-1-yl(morpholin-4-yl)methanone

2,3-dihydroindol-1-yl(morpholin-4-yl)methanone (PubChem CID 669642) has the molecular formula C13H16N2O2 and a molecular weight of 232.28 g/mol. Its IUPAC name is 2,3-dihydroindol-1-yl(morpholin-4-yl)methanone.

Molecular Properties

Compound Name2,3-dihydroindol-1-yl(morpholin-4-yl)methanone
PubChem CID669642
Molecular FormulaC13H16N2O2
Molecular Weight232.28 g/mol
Exact Mass232.12
IUPAC Name2,3-dihydroindol-1-yl(morpholin-4-yl)methanone
SMILESO=C(N1CCOCC1)N1CCc2ccccc21
InChIInChI=1S/C13H16N2O2/c16-13(14-7-9-17-10-8-14)15-6-5-11-3-1-2-4-12(11)15/h1-4H,5-10H2
InChIKeyPCQMYNZGLUFJCE-UHFFFAOYSA-N
XLogP1.50
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.28
LogP ≤ 51.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,3-dihydroindol-1-yl(morpholin-4-yl)methanone?
The IUPAC name of 2,3-dihydroindol-1-yl(morpholin-4-yl)methanone (CID 669642) is 2,3-dihydroindol-1-yl(morpholin-4-yl)methanone.
What is the SMILES notation for 2,3-dihydroindol-1-yl(morpholin-4-yl)methanone?
The canonical SMILES for 2,3-dihydroindol-1-yl(morpholin-4-yl)methanone is O=C(N1CCOCC1)N1CCc2ccccc21.
What is the InChIKey of 2,3-dihydroindol-1-yl(morpholin-4-yl)methanone?
The InChIKey is PCQMYNZGLUFJCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O2/c16-13(14-7-9-17-10-8-14)15-6-5-11-3-1-2-4-12(11)15/h1-4H,5-10H2.
What are the key properties of 2,3-dihydroindol-1-yl(morpholin-4-yl)methanone?
2,3-dihydroindol-1-yl(morpholin-4-yl)methanone has a molecular weight of 232.28 g/mol, XLogP of 1.50, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydroindol-1-yl(morpholin-4-yl)methanone is sourced from PubChem (CID 669642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).