N-[1-[5-(1-acetamidoethyl)-1,3,4-oxadiazol-2-yl]ethyl]acetamide

C10H16N4O3 — CID 59539442

IUPACN-[1-[5-(1-acetamidoethyl)-1,3,4-oxadiazol-2-yl]ethyl]acetamide
SMILESCC(=O)NC(C)c1nnc(C(C)NC(C)=O)o1
InChIInChI=1S/C10H16N4O3/c1-5(11-7(3)15)9-13-14-10(17-9)6(2)12-8(4)16/h5-6H,1-4H3,(H,11,15)(H,12,16)
InChIKeyWKXDUQCUYCYZAG-UHFFFAOYSA-N
MW240.26 g/mol
LogP0.46
Rot. Bonds4

About N-[1-[5-(1-acetamidoethyl)-1,3,4-oxadiazol-2-yl]ethyl]acetamide

N-[1-[5-(1-acetamidoethyl)-1,3,4-oxadiazol-2-yl]ethyl]acetamide (PubChem CID 59539442) has the molecular formula C10H16N4O3 and a molecular weight of 240.26 g/mol. Its IUPAC name is N-[1-[5-(1-acetamidoethyl)-1,3,4-oxadiazol-2-yl]ethyl]acetamide.

Molecular Properties

Compound NameN-[1-[5-(1-acetamidoethyl)-1,3,4-oxadiazol-2-yl]ethyl]acetamide
PubChem CID59539442
Molecular FormulaC10H16N4O3
Molecular Weight240.26 g/mol
Exact Mass240.12
IUPAC NameN-[1-[5-(1-acetamidoethyl)-1,3,4-oxadiazol-2-yl]ethyl]acetamide
SMILESCC(=O)NC(C)c1nnc(C(C)NC(C)=O)o1
InChIInChI=1S/C10H16N4O3/c1-5(11-7(3)15)9-13-14-10(17-9)6(2)12-8(4)16/h5-6H,1-4H3,(H,11,15)(H,12,16)
InChIKeyWKXDUQCUYCYZAG-UHFFFAOYSA-N
XLogP0.46
TPSA97.12 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.26
LogP ≤ 50.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[1-[5-(1-acetamidoethyl)-1,3,4-oxadiazol-2-yl]ethyl]acetamide?
The IUPAC name of N-[1-[5-(1-acetamidoethyl)-1,3,4-oxadiazol-2-yl]ethyl]acetamide (CID 59539442) is N-[1-[5-(1-acetamidoethyl)-1,3,4-oxadiazol-2-yl]ethyl]acetamide.
What is the SMILES notation for N-[1-[5-(1-acetamidoethyl)-1,3,4-oxadiazol-2-yl]ethyl]acetamide?
The canonical SMILES for N-[1-[5-(1-acetamidoethyl)-1,3,4-oxadiazol-2-yl]ethyl]acetamide is CC(=O)NC(C)c1nnc(C(C)NC(C)=O)o1.
What is the InChIKey of N-[1-[5-(1-acetamidoethyl)-1,3,4-oxadiazol-2-yl]ethyl]acetamide?
The InChIKey is WKXDUQCUYCYZAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O3/c1-5(11-7(3)15)9-13-14-10(17-9)6(2)12-8(4)16/h5-6H,1-4H3,(H,11,15)(H,12,16).
What are the key properties of N-[1-[5-(1-acetamidoethyl)-1,3,4-oxadiazol-2-yl]ethyl]acetamide?
N-[1-[5-(1-acetamidoethyl)-1,3,4-oxadiazol-2-yl]ethyl]acetamide has a molecular weight of 240.26 g/mol, XLogP of 0.46, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[5-(1-acetamidoethyl)-1,3,4-oxadiazol-2-yl]ethyl]acetamide is sourced from PubChem (CID 59539442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).