N-ethyl-2-(3-methyl-1,2,4-oxadiazol-5-yl)propan-2-amine

C8H15N3O — CID 62819214

IUPACN-ethyl-2-(3-methyl-1,2,4-oxadiazol-5-yl)propan-2-amine
SMILESCCNC(C)(C)c1nc(C)no1
InChIInChI=1S/C8H15N3O/c1-5-9-8(3,4)7-10-6(2)11-12-7/h9H,5H2,1-4H3
InChIKeyWPNZYAFFXJMJMD-UHFFFAOYSA-N
MW169.23 g/mol
LogP1.22
Rot. Bonds3

About N-ethyl-2-(3-methyl-1,2,4-oxadiazol-5-yl)propan-2-amine

N-ethyl-2-(3-methyl-1,2,4-oxadiazol-5-yl)propan-2-amine (PubChem CID 62819214) has the molecular formula C8H15N3O and a molecular weight of 169.23 g/mol. Its IUPAC name is N-ethyl-2-(3-methyl-1,2,4-oxadiazol-5-yl)propan-2-amine.

Molecular Properties

Compound NameN-ethyl-2-(3-methyl-1,2,4-oxadiazol-5-yl)propan-2-amine
PubChem CID62819214
Molecular FormulaC8H15N3O
Molecular Weight169.23 g/mol
Exact Mass169.12
IUPAC NameN-ethyl-2-(3-methyl-1,2,4-oxadiazol-5-yl)propan-2-amine
SMILESCCNC(C)(C)c1nc(C)no1
InChIInChI=1S/C8H15N3O/c1-5-9-8(3,4)7-10-6(2)11-12-7/h9H,5H2,1-4H3
InChIKeyWPNZYAFFXJMJMD-UHFFFAOYSA-N
XLogP1.22
TPSA50.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.23
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(3-methyl-1,2,4-oxadiazol-5-yl)propan-2-amine?
The IUPAC name of N-ethyl-2-(3-methyl-1,2,4-oxadiazol-5-yl)propan-2-amine (CID 62819214) is N-ethyl-2-(3-methyl-1,2,4-oxadiazol-5-yl)propan-2-amine.
What is the SMILES notation for N-ethyl-2-(3-methyl-1,2,4-oxadiazol-5-yl)propan-2-amine?
The canonical SMILES for N-ethyl-2-(3-methyl-1,2,4-oxadiazol-5-yl)propan-2-amine is CCNC(C)(C)c1nc(C)no1.
What is the InChIKey of N-ethyl-2-(3-methyl-1,2,4-oxadiazol-5-yl)propan-2-amine?
The InChIKey is WPNZYAFFXJMJMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3O/c1-5-9-8(3,4)7-10-6(2)11-12-7/h9H,5H2,1-4H3.
What are the key properties of N-ethyl-2-(3-methyl-1,2,4-oxadiazol-5-yl)propan-2-amine?
N-ethyl-2-(3-methyl-1,2,4-oxadiazol-5-yl)propan-2-amine has a molecular weight of 169.23 g/mol, XLogP of 1.22, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(3-methyl-1,2,4-oxadiazol-5-yl)propan-2-amine is sourced from PubChem (CID 62819214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).