N-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl]acetamide

C14H15N3O2 — CID 139412881

IUPACN-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl]acetamide
SMILESCC(=O)NC1CCc2cc(-c3noc(C)n3)ccc21
InChIInChI=1S/C14H15N3O2/c1-8(18)15-13-6-4-10-7-11(3-5-12(10)13)14-16-9(2)19-17-14/h3,5,7,13H,4,6H2,1-2H3,(H,15,18)
InChIKeySTKAMFRSRRJVNX-UHFFFAOYSA-N
MW257.29 g/mol
LogP2.17
Rot. Bonds2

About N-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl]acetamide

N-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl]acetamide (PubChem CID 139412881) has the molecular formula C14H15N3O2 and a molecular weight of 257.29 g/mol. Its IUPAC name is N-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl]acetamide.

Molecular Properties

Compound NameN-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl]acetamide
PubChem CID139412881
Molecular FormulaC14H15N3O2
Molecular Weight257.29 g/mol
Exact Mass257.12
IUPAC NameN-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl]acetamide
SMILESCC(=O)NC1CCc2cc(-c3noc(C)n3)ccc21
InChIInChI=1S/C14H15N3O2/c1-8(18)15-13-6-4-10-7-11(3-5-12(10)13)14-16-9(2)19-17-14/h3,5,7,13H,4,6H2,1-2H3,(H,15,18)
InChIKeySTKAMFRSRRJVNX-UHFFFAOYSA-N
XLogP2.17
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl]acetamide?
The IUPAC name of N-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl]acetamide (CID 139412881) is N-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl]acetamide.
What is the SMILES notation for N-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl]acetamide?
The canonical SMILES for N-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl]acetamide is CC(=O)NC1CCc2cc(-c3noc(C)n3)ccc21.
What is the InChIKey of N-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl]acetamide?
The InChIKey is STKAMFRSRRJVNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O2/c1-8(18)15-13-6-4-10-7-11(3-5-12(10)13)14-16-9(2)19-17-14/h3,5,7,13H,4,6H2,1-2H3,(H,15,18).
What are the key properties of N-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl]acetamide?
N-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl]acetamide has a molecular weight of 257.29 g/mol, XLogP of 2.17, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl]acetamide is sourced from PubChem (CID 139412881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).