2-(4-chlorophenyl)-5-(1H-indol-3-yl)-1,3,4-oxadiazole

C16H10ClN3O — CID 135966060

IUPAC2-(4-chlorophenyl)-5-(1H-indol-3-yl)-1,3,4-oxadiazole
SMILESClc1ccc(-c2nnc(-c3c[nH]c4ccccc34)o2)cc1
InChIInChI=1S/C16H10ClN3O/c17-11-7-5-10(6-8-11)15-19-20-16(21-15)13-9-18-14-4-2-1-3-12(13)14/h1-9,18H
InChIKeyRFNNOKOGDAAVIM-UHFFFAOYSA-N
MW295.73 g/mol
LogP4.54
Rot. Bonds2

About 2-(4-chlorophenyl)-5-(1H-indol-3-yl)-1,3,4-oxadiazole

2-(4-chlorophenyl)-5-(1H-indol-3-yl)-1,3,4-oxadiazole (PubChem CID 135966060) has the molecular formula C16H10ClN3O and a molecular weight of 295.73 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-5-(1H-indol-3-yl)-1,3,4-oxadiazole.

Molecular Properties

Compound Name2-(4-chlorophenyl)-5-(1H-indol-3-yl)-1,3,4-oxadiazole
PubChem CID135966060
Molecular FormulaC16H10ClN3O
Molecular Weight295.73 g/mol
Exact Mass295.05
IUPAC Name2-(4-chlorophenyl)-5-(1H-indol-3-yl)-1,3,4-oxadiazole
SMILESClc1ccc(-c2nnc(-c3c[nH]c4ccccc34)o2)cc1
InChIInChI=1S/C16H10ClN3O/c17-11-7-5-10(6-8-11)15-19-20-16(21-15)13-9-18-14-4-2-1-3-12(13)14/h1-9,18H
InChIKeyRFNNOKOGDAAVIM-UHFFFAOYSA-N
XLogP4.54
TPSA54.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.73
LogP ≤ 54.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-5-(1H-indol-3-yl)-1,3,4-oxadiazole?
The IUPAC name of 2-(4-chlorophenyl)-5-(1H-indol-3-yl)-1,3,4-oxadiazole (CID 135966060) is 2-(4-chlorophenyl)-5-(1H-indol-3-yl)-1,3,4-oxadiazole.
What is the SMILES notation for 2-(4-chlorophenyl)-5-(1H-indol-3-yl)-1,3,4-oxadiazole?
The canonical SMILES for 2-(4-chlorophenyl)-5-(1H-indol-3-yl)-1,3,4-oxadiazole is Clc1ccc(-c2nnc(-c3c[nH]c4ccccc34)o2)cc1.
What is the InChIKey of 2-(4-chlorophenyl)-5-(1H-indol-3-yl)-1,3,4-oxadiazole?
The InChIKey is RFNNOKOGDAAVIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10ClN3O/c17-11-7-5-10(6-8-11)15-19-20-16(21-15)13-9-18-14-4-2-1-3-12(13)14/h1-9,18H.
What are the key properties of 2-(4-chlorophenyl)-5-(1H-indol-3-yl)-1,3,4-oxadiazole?
2-(4-chlorophenyl)-5-(1H-indol-3-yl)-1,3,4-oxadiazole has a molecular weight of 295.73 g/mol, XLogP of 4.54, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-5-(1H-indol-3-yl)-1,3,4-oxadiazole is sourced from PubChem (CID 135966060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).