N-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]propanamide

C8H13N3O2 — CID 110320204

IUPACN-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]propanamide
SMILESCCC(=O)NCCc1nnc(C)o1
InChIInChI=1S/C8H13N3O2/c1-3-7(12)9-5-4-8-11-10-6(2)13-8/h3-5H2,1-2H3,(H,9,12)
InChIKeyLICUKZZVRRYTMY-UHFFFAOYSA-N
MW183.21 g/mol
LogP0.45
Rot. Bonds4

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

N-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]propanamide (PubChem CID 110320204) has the molecular formula C8H13N3O2 and a molecular weight of 183.21 g/mol. Its IUPAC name is N-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]propanamide.

Molecular Properties

Compound NameN-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]propanamide
PubChem CID110320204
Molecular FormulaC8H13N3O2
Molecular Weight183.21 g/mol
Exact Mass183.10
IUPAC NameN-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]propanamide
SMILESCCC(=O)NCCc1nnc(C)o1
InChIInChI=1S/C8H13N3O2/c1-3-7(12)9-5-4-8-11-10-6(2)13-8/h3-5H2,1-2H3,(H,9,12)
InChIKeyLICUKZZVRRYTMY-UHFFFAOYSA-N
XLogP0.45
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.21
LogP ≤ 50.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

ethyl N-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]carbamate
CID 110320280
methyl N-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]carbamate
CID 110320279
N-[2-[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]ethyl]propanamide
CID 110321394
N-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]propan-1-amine
CID 62162393
N-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]-4-phenylbenzamide
CID 110320276
3-(5-methyl-1,3,4-oxadiazol-2-yl)-N-(2-morpholin-4-ylethyl)propanamide
CID 110333564
2-methoxy-N-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]benzamide
CID 110320225
N-[2-[5-(3-methoxyphenyl)-1,3,4-oxadiazol-2-yl]ethyl]propanamide
CID 110321801
2-methyl-N-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]propan-2-amine
CID 62163830
(5-methyl-1,3,4-oxadiazol-2-yl)methylurea
CID 130738422
4-(dimethylsulfamoyl)-N-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]benzamide
CID 110320250
N-[2-(5-methylfuran-2-yl)ethyl]propanamide
CID 110872482

Frequently Asked Questions

What is the IUPAC name of N-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]propanamide?
The IUPAC name of N-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]propanamide (CID 110320204) is N-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]propanamide.
What is the SMILES notation for N-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]propanamide?
The canonical SMILES for N-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]propanamide is CCC(=O)NCCc1nnc(C)o1.
What is the InChIKey of N-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]propanamide?
The InChIKey is LICUKZZVRRYTMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3O2/c1-3-7(12)9-5-4-8-11-10-6(2)13-8/h3-5H2,1-2H3,(H,9,12).
What are the key properties of N-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]propanamide?
N-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]propanamide has a molecular weight of 183.21 g/mol, XLogP of 0.45, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]propanamide is sourced from PubChem (CID 110320204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).