2-(1-methylindol-3-yl)-N-[5-(2-methyl-1,3-thiazol-4-yl)-1,3,4-oxadiazol-2-yl]acetamide

C17H15N5O2S — CID 90602717

IUPAC2-(1-methylindol-3-yl)-N-[5-(2-methyl-1,3-thiazol-4-yl)-1,3,4-oxadiazol-2-yl]acetamide
SMILESCc1nc(-c2nnc(NC(=O)Cc3cn(C)c4ccccc34)o2)cs1
InChIInChI=1S/C17H15N5O2S/c1-10-18-13(9-25-10)16-20-21-17(24-16)19-15(23)7-11-8-22(2)14-6-4-3-5-12(11)14/h3-6,8-9H,7H2,1-2H3,(H,19,21,23)
InChIKeyMSJLNCGFPISGMQ-UHFFFAOYSA-N
MW353.41 g/mol
LogP3.17
Rot. Bonds4

About 2-(1-methylindol-3-yl)-N-[5-(2-methyl-1,3-thiazol-4-yl)-1,3,4-oxadiazol-2-yl]acetamide

2-(1-methylindol-3-yl)-N-[5-(2-methyl-1,3-thiazol-4-yl)-1,3,4-oxadiazol-2-yl]acetamide (PubChem CID 90602717) has the molecular formula C17H15N5O2S and a molecular weight of 353.41 g/mol. Its IUPAC name is 2-(1-methylindol-3-yl)-N-[5-(2-methyl-1,3-thiazol-4-yl)-1,3,4-oxadiazol-2-yl]acetamide.

Molecular Properties

Compound Name2-(1-methylindol-3-yl)-N-[5-(2-methyl-1,3-thiazol-4-yl)-1,3,4-oxadiazol-2-yl]acetamide
PubChem CID90602717
Molecular FormulaC17H15N5O2S
Molecular Weight353.41 g/mol
Exact Mass353.09
IUPAC Name2-(1-methylindol-3-yl)-N-[5-(2-methyl-1,3-thiazol-4-yl)-1,3,4-oxadiazol-2-yl]acetamide
SMILESCc1nc(-c2nnc(NC(=O)Cc3cn(C)c4ccccc34)o2)cs1
InChIInChI=1S/C17H15N5O2S/c1-10-18-13(9-25-10)16-20-21-17(24-16)19-15(23)7-11-8-22(2)14-6-4-3-5-12(11)14/h3-6,8-9H,7H2,1-2H3,(H,19,21,23)
InChIKeyMSJLNCGFPISGMQ-UHFFFAOYSA-N
XLogP3.17
TPSA85.84 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.41
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-[5-(2-methyl-1,3-thiazol-4-yl)-1,3,4-oxadiazol-2-yl]-2-naphthalen-1-ylacetamide
CID 90602823
N-[5-(dimethylamino)-1,3,4-oxadiazol-2-yl]-2-(1-methylindol-3-yl)acetamide
CID 155910308
2-(4-fluorophenyl)-N-[5-(2-methyl-1,3-thiazol-4-yl)-1,3,4-oxadiazol-2-yl]acetamide
CID 90602820
2-(1-methylindol-3-yl)-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]acetamide
CID 47078967
2-methyl-N-[5-(2-methyl-1,3-thiazol-4-yl)-1,3,4-oxadiazol-2-yl]benzamide
CID 90602753
N-[5-(2-methyl-1,3-thiazol-4-yl)-1,3,4-oxadiazol-2-yl]-2-phenylbutanamide
CID 90602825
2-ethoxy-N-[5-(2-methyl-1,3-thiazol-4-yl)-1,3,4-oxadiazol-2-yl]naphthalene-1-carboxamide
CID 90602796
N-(4-tert-butyl-1,3-thiazol-2-yl)-2-(1-methylindol-3-yl)acetamide
CID 166629500
N-[5-(2-methyl-1,3-thiazol-4-yl)-1,3,4-oxadiazol-2-yl]-2-phenyltriazole-4-carboxamide
CID 90602681
N-(2-ethylphenyl)-2-(1-methylindol-3-yl)acetamide
CID 4523543
N-(5-cyano-1,3-thiazol-2-yl)-2-(1-methylindol-3-yl)acetamide
CID 90603505
3-methoxy-N-[5-(2-methyl-1,3-thiazol-4-yl)-1,3,4-oxadiazol-2-yl]naphthalene-2-carboxamide
CID 90602900

Frequently Asked Questions

What is the IUPAC name of 2-(1-methylindol-3-yl)-N-[5-(2-methyl-1,3-thiazol-4-yl)-1,3,4-oxadiazol-2-yl]acetamide?
The IUPAC name of 2-(1-methylindol-3-yl)-N-[5-(2-methyl-1,3-thiazol-4-yl)-1,3,4-oxadiazol-2-yl]acetamide (CID 90602717) is 2-(1-methylindol-3-yl)-N-[5-(2-methyl-1,3-thiazol-4-yl)-1,3,4-oxadiazol-2-yl]acetamide.
What is the SMILES notation for 2-(1-methylindol-3-yl)-N-[5-(2-methyl-1,3-thiazol-4-yl)-1,3,4-oxadiazol-2-yl]acetamide?
The canonical SMILES for 2-(1-methylindol-3-yl)-N-[5-(2-methyl-1,3-thiazol-4-yl)-1,3,4-oxadiazol-2-yl]acetamide is Cc1nc(-c2nnc(NC(=O)Cc3cn(C)c4ccccc34)o2)cs1.
What is the InChIKey of 2-(1-methylindol-3-yl)-N-[5-(2-methyl-1,3-thiazol-4-yl)-1,3,4-oxadiazol-2-yl]acetamide?
The InChIKey is MSJLNCGFPISGMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N5O2S/c1-10-18-13(9-25-10)16-20-21-17(24-16)19-15(23)7-11-8-22(2)14-6-4-3-5-12(11)14/h3-6,8-9H,7H2,1-2H3,(H,19,21,23).
What are the key properties of 2-(1-methylindol-3-yl)-N-[5-(2-methyl-1,3-thiazol-4-yl)-1,3,4-oxadiazol-2-yl]acetamide?
2-(1-methylindol-3-yl)-N-[5-(2-methyl-1,3-thiazol-4-yl)-1,3,4-oxadiazol-2-yl]acetamide has a molecular weight of 353.41 g/mol, XLogP of 3.17, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methylindol-3-yl)-N-[5-(2-methyl-1,3-thiazol-4-yl)-1,3,4-oxadiazol-2-yl]acetamide is sourced from PubChem (CID 90602717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).