2-ethyl-5-(1-ethyl-6-methoxyindol-3-yl)-1,3,4-oxadiazole

C15H17N3O2 — CID 11565281

IUPAC2-ethyl-5-(1-ethyl-6-methoxyindol-3-yl)-1,3,4-oxadiazole
SMILESCCc1nnc(-c2cn(CC)c3cc(OC)ccc23)o1
InChIInChI=1S/C15H17N3O2/c1-4-14-16-17-15(20-14)12-9-18(5-2)13-8-10(19-3)6-7-11(12)13/h6-9H,4-5H2,1-3H3
InChIKeySGTALWNOBYDUOX-UHFFFAOYSA-N
MW271.32 g/mol
LogP3.28
Rot. Bonds4

About 2-ethyl-5-(1-ethyl-6-methoxyindol-3-yl)-1,3,4-oxadiazole

2-ethyl-5-(1-ethyl-6-methoxyindol-3-yl)-1,3,4-oxadiazole (PubChem CID 11565281) has the molecular formula C15H17N3O2 and a molecular weight of 271.32 g/mol. Its IUPAC name is 2-ethyl-5-(1-ethyl-6-methoxyindol-3-yl)-1,3,4-oxadiazole.

Molecular Properties

Compound Name2-ethyl-5-(1-ethyl-6-methoxyindol-3-yl)-1,3,4-oxadiazole
PubChem CID11565281
Molecular FormulaC15H17N3O2
Molecular Weight271.32 g/mol
Exact Mass271.13
IUPAC Name2-ethyl-5-(1-ethyl-6-methoxyindol-3-yl)-1,3,4-oxadiazole
SMILESCCc1nnc(-c2cn(CC)c3cc(OC)ccc23)o1
InChIInChI=1S/C15H17N3O2/c1-4-14-16-17-15(20-14)12-9-18(5-2)13-8-10(19-3)6-7-11(12)13/h6-9H,4-5H2,1-3H3
InChIKeySGTALWNOBYDUOX-UHFFFAOYSA-N
XLogP3.28
TPSA53.08 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 53.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-5-(1-ethyl-6-methoxyindol-3-yl)-1,3,4-oxadiazole?
The IUPAC name of 2-ethyl-5-(1-ethyl-6-methoxyindol-3-yl)-1,3,4-oxadiazole (CID 11565281) is 2-ethyl-5-(1-ethyl-6-methoxyindol-3-yl)-1,3,4-oxadiazole.
What is the SMILES notation for 2-ethyl-5-(1-ethyl-6-methoxyindol-3-yl)-1,3,4-oxadiazole?
The canonical SMILES for 2-ethyl-5-(1-ethyl-6-methoxyindol-3-yl)-1,3,4-oxadiazole is CCc1nnc(-c2cn(CC)c3cc(OC)ccc23)o1.
What is the InChIKey of 2-ethyl-5-(1-ethyl-6-methoxyindol-3-yl)-1,3,4-oxadiazole?
The InChIKey is SGTALWNOBYDUOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O2/c1-4-14-16-17-15(20-14)12-9-18(5-2)13-8-10(19-3)6-7-11(12)13/h6-9H,4-5H2,1-3H3.
What are the key properties of 2-ethyl-5-(1-ethyl-6-methoxyindol-3-yl)-1,3,4-oxadiazole?
2-ethyl-5-(1-ethyl-6-methoxyindol-3-yl)-1,3,4-oxadiazole has a molecular weight of 271.32 g/mol, XLogP of 3.28, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-5-(1-ethyl-6-methoxyindol-3-yl)-1,3,4-oxadiazole is sourced from PubChem (CID 11565281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).