N-[2-(5-tert-butyl-1,2,4-oxadiazol-3-yl)ethyl]-2-ethylbutanamide

C14H25N3O2 — CID 110294284

IUPACN-[2-(5-tert-butyl-1,2,4-oxadiazol-3-yl)ethyl]-2-ethylbutanamide
SMILESCCC(CC)C(=O)NCCc1noc(C(C)(C)C)n1
InChIInChI=1S/C14H25N3O2/c1-6-10(7-2)12(18)15-9-8-11-16-13(19-17-11)14(3,4)5/h10H,6-9H2,1-5H3,(H,15,18)
InChIKeyQTOFFGPJGVUFCS-UHFFFAOYSA-N
MW267.37 g/mol
LogP2.46
Rot. Bonds6

About N-[2-(5-tert-butyl-1,2,4-oxadiazol-3-yl)ethyl]-2-ethylbutanamide

N-[2-(5-tert-butyl-1,2,4-oxadiazol-3-yl)ethyl]-2-ethylbutanamide (PubChem CID 110294284) has the molecular formula C14H25N3O2 and a molecular weight of 267.37 g/mol. Its IUPAC name is N-[2-(5-tert-butyl-1,2,4-oxadiazol-3-yl)ethyl]-2-ethylbutanamide.

Molecular Properties

Compound NameN-[2-(5-tert-butyl-1,2,4-oxadiazol-3-yl)ethyl]-2-ethylbutanamide
PubChem CID110294284
Molecular FormulaC14H25N3O2
Molecular Weight267.37 g/mol
Exact Mass267.19
IUPAC NameN-[2-(5-tert-butyl-1,2,4-oxadiazol-3-yl)ethyl]-2-ethylbutanamide
SMILESCCC(CC)C(=O)NCCc1noc(C(C)(C)C)n1
InChIInChI=1S/C14H25N3O2/c1-6-10(7-2)12(18)15-9-8-11-16-13(19-17-11)14(3,4)5/h10H,6-9H2,1-5H3,(H,15,18)
InChIKeyQTOFFGPJGVUFCS-UHFFFAOYSA-N
XLogP2.46
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[2-(5-tert-butyl-1,2,4-oxadiazol-3-yl)ethyl]-2-ethylbutanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-[5-(Propan-2-yl)-1,2,4-oxadiazol-3-yl]piperidine hydrochloride
CID 50988079
2-(5-(Propan-2-yl)-1,2,4-oxadiazol-3-yl)ethan-1-amine
CID 17604997
4-(5-Methyl-1,2,4-oxadiazol-3-yl)piperidine hydrochloride
CID 21098311
4-(3-(Propan-2-yl)-1,2,4-oxadiazol-5-yl)piperidine
CID 24208845
4-(3-Methyl-1,2,4-oxadiazol-5-yl)piperidine hydrochloride
CID 45791888
3-(5-Methyl-1,2,4-oxadiazol-3-yl)piperidine hydrochloride
CID 50988177
2-(5-Tert-butyl-1,2,4-oxadiazol-3-yl)ethan-1-amine hydrochloride
CID 52983672
4-(3-Isopropyl-1,2,4-oxadiazol-5-YL)piperidine hydrochloride
CID 53400827
4-[(5-Methyl-1,2,4-oxadiazol-3-YL)methyl]piperidine hydrochloride
CID 53433778
4-Methyl-4-(3-methyl-1,2,4-oxadiazol-5-yl)piperidine hydrochloride
CID 71298861
N-(cyclopropylmethyl)-3-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)propanamide
CID 45884185
3-(5-Isopropyl-[1,2,4]oxadiazol-3-yl)-piperidine
CID 50988080

Frequently Asked Questions

What is the IUPAC name of N-[2-(5-tert-butyl-1,2,4-oxadiazol-3-yl)ethyl]-2-ethylbutanamide?
The IUPAC name of N-[2-(5-tert-butyl-1,2,4-oxadiazol-3-yl)ethyl]-2-ethylbutanamide (CID 110294284) is N-[2-(5-tert-butyl-1,2,4-oxadiazol-3-yl)ethyl]-2-ethylbutanamide.
What is the SMILES notation for N-[2-(5-tert-butyl-1,2,4-oxadiazol-3-yl)ethyl]-2-ethylbutanamide?
The canonical SMILES for N-[2-(5-tert-butyl-1,2,4-oxadiazol-3-yl)ethyl]-2-ethylbutanamide is CCC(CC)C(=O)NCCc1noc(C(C)(C)C)n1.
What is the InChIKey of N-[2-(5-tert-butyl-1,2,4-oxadiazol-3-yl)ethyl]-2-ethylbutanamide?
The InChIKey is QTOFFGPJGVUFCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O2/c1-6-10(7-2)12(18)15-9-8-11-16-13(19-17-11)14(3,4)5/h10H,6-9H2,1-5H3,(H,15,18).
What are the key properties of N-[2-(5-tert-butyl-1,2,4-oxadiazol-3-yl)ethyl]-2-ethylbutanamide?
N-[2-(5-tert-butyl-1,2,4-oxadiazol-3-yl)ethyl]-2-ethylbutanamide has a molecular weight of 267.37 g/mol, XLogP of 2.46, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(5-tert-butyl-1,2,4-oxadiazol-3-yl)ethyl]-2-ethylbutanamide is sourced from PubChem (CID 110294284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).