N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-3-(ethylamino)propanamide

C10H16N4O2 — CID 62835566

IUPACN-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-3-(ethylamino)propanamide
SMILESCCNCCC(=O)Nc1nnc(C2CC2)o1
InChIInChI=1S/C10H16N4O2/c1-2-11-6-5-8(15)12-10-14-13-9(16-10)7-3-4-7/h7,11H,2-6H2,1H3,(H,12,14,15)
InChIKeyURCLXOCFXBEGEU-UHFFFAOYSA-N
MW224.26 g/mol
LogP0.89
Rot. Bonds6

About N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-3-(ethylamino)propanamide

N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-3-(ethylamino)propanamide (PubChem CID 62835566) has the molecular formula C10H16N4O2 and a molecular weight of 224.26 g/mol. Its IUPAC name is N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-3-(ethylamino)propanamide.

Molecular Properties

Compound NameN-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-3-(ethylamino)propanamide
PubChem CID62835566
Molecular FormulaC10H16N4O2
Molecular Weight224.26 g/mol
Exact Mass224.13
IUPAC NameN-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-3-(ethylamino)propanamide
SMILESCCNCCC(=O)Nc1nnc(C2CC2)o1
InChIInChI=1S/C10H16N4O2/c1-2-11-6-5-8(15)12-10-14-13-9(16-10)7-3-4-7/h7,11H,2-6H2,1H3,(H,12,14,15)
InChIKeyURCLXOCFXBEGEU-UHFFFAOYSA-N
XLogP0.89
TPSA80.05 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 50.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-3-(ethylamino)propanamide?
The IUPAC name of N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-3-(ethylamino)propanamide (CID 62835566) is N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-3-(ethylamino)propanamide.
What is the SMILES notation for N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-3-(ethylamino)propanamide?
The canonical SMILES for N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-3-(ethylamino)propanamide is CCNCCC(=O)Nc1nnc(C2CC2)o1.
What is the InChIKey of N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-3-(ethylamino)propanamide?
The InChIKey is URCLXOCFXBEGEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O2/c1-2-11-6-5-8(15)12-10-14-13-9(16-10)7-3-4-7/h7,11H,2-6H2,1H3,(H,12,14,15).
What are the key properties of N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-3-(ethylamino)propanamide?
N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-3-(ethylamino)propanamide has a molecular weight of 224.26 g/mol, XLogP of 0.89, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-3-(ethylamino)propanamide is sourced from PubChem (CID 62835566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).