2-(2,3-dihydro-1H-indol-3-yl)-N-(1,2,4-oxadiazol-3-ylmethyl)acetamide

C13H14N4O2 — CID 106396930

IUPAC2-(2,3-dihydro-1H-indol-3-yl)-N-(1,2,4-oxadiazol-3-ylmethyl)acetamide
SMILESO=C(CC1CNc2ccccc21)NCc1ncon1
InChIInChI=1S/C13H14N4O2/c18-13(15-7-12-16-8-19-17-12)5-9-6-14-11-4-2-1-3-10(9)11/h1-4,8-9,14H,5-7H2,(H,15,18)
InChIKeyZETCWPAGBHCRFY-UHFFFAOYSA-N
MW258.28 g/mol
LogP1.29
Rot. Bonds4

About 2-(2,3-dihydro-1H-indol-3-yl)-N-(1,2,4-oxadiazol-3-ylmethyl)acetamide

2-(2,3-dihydro-1H-indol-3-yl)-N-(1,2,4-oxadiazol-3-ylmethyl)acetamide (PubChem CID 106396930) has the molecular formula C13H14N4O2 and a molecular weight of 258.28 g/mol. Its IUPAC name is 2-(2,3-dihydro-1H-indol-3-yl)-N-(1,2,4-oxadiazol-3-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(2,3-dihydro-1H-indol-3-yl)-N-(1,2,4-oxadiazol-3-ylmethyl)acetamide
PubChem CID106396930
Molecular FormulaC13H14N4O2
Molecular Weight258.28 g/mol
Exact Mass258.11
IUPAC Name2-(2,3-dihydro-1H-indol-3-yl)-N-(1,2,4-oxadiazol-3-ylmethyl)acetamide
SMILESO=C(CC1CNc2ccccc21)NCc1ncon1
InChIInChI=1S/C13H14N4O2/c18-13(15-7-12-16-8-19-17-12)5-9-6-14-11-4-2-1-3-10(9)11/h1-4,8-9,14H,5-7H2,(H,15,18)
InChIKeyZETCWPAGBHCRFY-UHFFFAOYSA-N
XLogP1.29
TPSA80.05 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.28
LogP ≤ 51.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydro-1H-indol-3-yl)-N-(1,2,4-oxadiazol-3-ylmethyl)acetamide?
The IUPAC name of 2-(2,3-dihydro-1H-indol-3-yl)-N-(1,2,4-oxadiazol-3-ylmethyl)acetamide (CID 106396930) is 2-(2,3-dihydro-1H-indol-3-yl)-N-(1,2,4-oxadiazol-3-ylmethyl)acetamide.
What is the SMILES notation for 2-(2,3-dihydro-1H-indol-3-yl)-N-(1,2,4-oxadiazol-3-ylmethyl)acetamide?
The canonical SMILES for 2-(2,3-dihydro-1H-indol-3-yl)-N-(1,2,4-oxadiazol-3-ylmethyl)acetamide is O=C(CC1CNc2ccccc21)NCc1ncon1.
What is the InChIKey of 2-(2,3-dihydro-1H-indol-3-yl)-N-(1,2,4-oxadiazol-3-ylmethyl)acetamide?
The InChIKey is ZETCWPAGBHCRFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N4O2/c18-13(15-7-12-16-8-19-17-12)5-9-6-14-11-4-2-1-3-10(9)11/h1-4,8-9,14H,5-7H2,(H,15,18).
What are the key properties of 2-(2,3-dihydro-1H-indol-3-yl)-N-(1,2,4-oxadiazol-3-ylmethyl)acetamide?
2-(2,3-dihydro-1H-indol-3-yl)-N-(1,2,4-oxadiazol-3-ylmethyl)acetamide has a molecular weight of 258.28 g/mol, XLogP of 1.29, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydro-1H-indol-3-yl)-N-(1,2,4-oxadiazol-3-ylmethyl)acetamide is sourced from PubChem (CID 106396930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).