N-(5-propyl-1,3,4-oxadiazol-2-yl)butanamide

C9H15N3O2 — CID 23629374

IUPACN-(5-propyl-1,3,4-oxadiazol-2-yl)butanamide
SMILESCCCC(=O)Nc1nnc(CCC)o1
InChIInChI=1S/C9H15N3O2/c1-3-5-7(13)10-9-12-11-8(14-9)6-4-2/h3-6H2,1-2H3,(H,10,12,13)
InChIKeyOUCKXUCYADFGHX-UHFFFAOYSA-N
MW197.24 g/mol
LogP1.76
Rot. Bonds5

About N-(5-propyl-1,3,4-oxadiazol-2-yl)butanamide

N-(5-propyl-1,3,4-oxadiazol-2-yl)butanamide (PubChem CID 23629374) has the molecular formula C9H15N3O2 and a molecular weight of 197.24 g/mol. Its IUPAC name is N-(5-propyl-1,3,4-oxadiazol-2-yl)butanamide.

Molecular Properties

Compound NameN-(5-propyl-1,3,4-oxadiazol-2-yl)butanamide
PubChem CID23629374
Molecular FormulaC9H15N3O2
Molecular Weight197.24 g/mol
Exact Mass197.12
IUPAC NameN-(5-propyl-1,3,4-oxadiazol-2-yl)butanamide
SMILESCCCC(=O)Nc1nnc(CCC)o1
InChIInChI=1S/C9H15N3O2/c1-3-5-7(13)10-9-12-11-8(14-9)6-4-2/h3-6H2,1-2H3,(H,10,12,13)
InChIKeyOUCKXUCYADFGHX-UHFFFAOYSA-N
XLogP1.76
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.24
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(5-propyl-1,3,4-oxadiazol-2-yl)butanamide?
The IUPAC name of N-(5-propyl-1,3,4-oxadiazol-2-yl)butanamide (CID 23629374) is N-(5-propyl-1,3,4-oxadiazol-2-yl)butanamide.
What is the SMILES notation for N-(5-propyl-1,3,4-oxadiazol-2-yl)butanamide?
The canonical SMILES for N-(5-propyl-1,3,4-oxadiazol-2-yl)butanamide is CCCC(=O)Nc1nnc(CCC)o1.
What is the InChIKey of N-(5-propyl-1,3,4-oxadiazol-2-yl)butanamide?
The InChIKey is OUCKXUCYADFGHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O2/c1-3-5-7(13)10-9-12-11-8(14-9)6-4-2/h3-6H2,1-2H3,(H,10,12,13).
What are the key properties of N-(5-propyl-1,3,4-oxadiazol-2-yl)butanamide?
N-(5-propyl-1,3,4-oxadiazol-2-yl)butanamide has a molecular weight of 197.24 g/mol, XLogP of 1.76, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-propyl-1,3,4-oxadiazol-2-yl)butanamide is sourced from PubChem (CID 23629374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).