1-[2-(oxan-2-yloxy)ethyl]-3H-indol-2-one

C15H19NO3 — CID 77211492

IUPAC1-[2-(oxan-2-yloxy)ethyl]-3H-indol-2-one
SMILESO=C1Cc2ccccc2N1CCOC1CCCCO1
InChIInChI=1S/C15H19NO3/c17-14-11-12-5-1-2-6-13(12)16(14)8-10-19-15-7-3-4-9-18-15/h1-2,5-6,15H,3-4,7-11H2
InChIKeyZHCRPZUAUITQFW-UHFFFAOYSA-N
MW261.32 g/mol
LogP2.12
Rot. Bonds4

About 1-[2-(oxan-2-yloxy)ethyl]-3H-indol-2-one

1-[2-(oxan-2-yloxy)ethyl]-3H-indol-2-one (PubChem CID 77211492) has the molecular formula C15H19NO3 and a molecular weight of 261.32 g/mol. Its IUPAC name is 1-[2-(oxan-2-yloxy)ethyl]-3H-indol-2-one.

Molecular Properties

Compound Name1-[2-(oxan-2-yloxy)ethyl]-3H-indol-2-one
PubChem CID77211492
Molecular FormulaC15H19NO3
Molecular Weight261.32 g/mol
Exact Mass261.14
IUPAC Name1-[2-(oxan-2-yloxy)ethyl]-3H-indol-2-one
SMILESO=C1Cc2ccccc2N1CCOC1CCCCO1
InChIInChI=1S/C15H19NO3/c17-14-11-12-5-1-2-6-13(12)16(14)8-10-19-15-7-3-4-9-18-15/h1-2,5-6,15H,3-4,7-11H2
InChIKeyZHCRPZUAUITQFW-UHFFFAOYSA-N
XLogP2.12
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 52.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2,9-bis[2-(oxan-2-yloxy)ethyl]-2,4,9,11-tetrazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaene
CID 101178662
1-(2-methoxyethyl)-3H-indol-2-one
CID 58486241
1-(2-hydroxyethyl)-3H-indol-2-one
CID 18624228
1-[2-[(2S)-oxan-2-yl]oxyethyl]quinolin-4-one
CID 99837452
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CID 70366070
2-[2-(oxan-2-yloxy)ethyl]phthalazin-1-one
CID 19979310
5-bromo-1-[2-(oxan-2-yloxy)ethyl]pyridin-2-one
CID 172614475
2-(2-phenoxyethoxy)oxane
CID 11736193
2-[[(2R)-1-[2-[(2R)-oxan-2-yl]oxyethyl]-5-oxopyrrolidin-2-yl]methylamino]isoindole-1,3-dione
CID 139606221
1-[4-(oxan-2-yloxy)butyl]pyrrolidin-2-one
CID 10977596
6-(2-fluorophenyl)-2-[2-[(2S)-oxan-2-yl]oxyethyl]pyridazin-3-one
CID 99842273
2-[2-(oxan-2-yloxy)ethyl]pyrrolo[1,2-d][1,2,4]triazin-1-one
CID 119037797

Frequently Asked Questions

What is the IUPAC name of 1-[2-(oxan-2-yloxy)ethyl]-3H-indol-2-one?
The IUPAC name of 1-[2-(oxan-2-yloxy)ethyl]-3H-indol-2-one (CID 77211492) is 1-[2-(oxan-2-yloxy)ethyl]-3H-indol-2-one.
What is the SMILES notation for 1-[2-(oxan-2-yloxy)ethyl]-3H-indol-2-one?
The canonical SMILES for 1-[2-(oxan-2-yloxy)ethyl]-3H-indol-2-one is O=C1Cc2ccccc2N1CCOC1CCCCO1.
What is the InChIKey of 1-[2-(oxan-2-yloxy)ethyl]-3H-indol-2-one?
The InChIKey is ZHCRPZUAUITQFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO3/c17-14-11-12-5-1-2-6-13(12)16(14)8-10-19-15-7-3-4-9-18-15/h1-2,5-6,15H,3-4,7-11H2.
What are the key properties of 1-[2-(oxan-2-yloxy)ethyl]-3H-indol-2-one?
1-[2-(oxan-2-yloxy)ethyl]-3H-indol-2-one has a molecular weight of 261.32 g/mol, XLogP of 2.12, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(oxan-2-yloxy)ethyl]-3H-indol-2-one is sourced from PubChem (CID 77211492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).