1-(5-ethyl-1,3,4-oxadiazol-2-yl)-N,N-dimethylmethanamine

C7H13N3O — CID 89036722

IUPAC1-(5-ethyl-1,3,4-oxadiazol-2-yl)-N,N-dimethylmethanamine
SMILESCCc1nnc(CN(C)C)o1
InChIInChI=1S/C7H13N3O/c1-4-6-8-9-7(11-6)5-10(2)3/h4-5H2,1-3H3
InChIKeyNSIAWBWBUPGQJS-UHFFFAOYSA-N
MW155.20 g/mol
LogP0.69
Rot. Bonds3

About 1-(5-ethyl-1,3,4-oxadiazol-2-yl)-N,N-dimethylmethanamine

1-(5-ethyl-1,3,4-oxadiazol-2-yl)-N,N-dimethylmethanamine (PubChem CID 89036722) has the molecular formula C7H13N3O and a molecular weight of 155.20 g/mol. Its IUPAC name is 1-(5-ethyl-1,3,4-oxadiazol-2-yl)-N,N-dimethylmethanamine.

Molecular Properties

Compound Name1-(5-ethyl-1,3,4-oxadiazol-2-yl)-N,N-dimethylmethanamine
PubChem CID89036722
Molecular FormulaC7H13N3O
Molecular Weight155.20 g/mol
Exact Mass155.11
IUPAC Name1-(5-ethyl-1,3,4-oxadiazol-2-yl)-N,N-dimethylmethanamine
SMILESCCc1nnc(CN(C)C)o1
InChIInChI=1S/C7H13N3O/c1-4-6-8-9-7(11-6)5-10(2)3/h4-5H2,1-3H3
InChIKeyNSIAWBWBUPGQJS-UHFFFAOYSA-N
XLogP0.69
TPSA42.16 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.20
LogP ≤ 50.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(5-ethyl-1,3,4-oxadiazol-2-yl)-N,N-dimethylmethanamine?
The IUPAC name of 1-(5-ethyl-1,3,4-oxadiazol-2-yl)-N,N-dimethylmethanamine (CID 89036722) is 1-(5-ethyl-1,3,4-oxadiazol-2-yl)-N,N-dimethylmethanamine.
What is the SMILES notation for 1-(5-ethyl-1,3,4-oxadiazol-2-yl)-N,N-dimethylmethanamine?
The canonical SMILES for 1-(5-ethyl-1,3,4-oxadiazol-2-yl)-N,N-dimethylmethanamine is CCc1nnc(CN(C)C)o1.
What is the InChIKey of 1-(5-ethyl-1,3,4-oxadiazol-2-yl)-N,N-dimethylmethanamine?
The InChIKey is NSIAWBWBUPGQJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N3O/c1-4-6-8-9-7(11-6)5-10(2)3/h4-5H2,1-3H3.
What are the key properties of 1-(5-ethyl-1,3,4-oxadiazol-2-yl)-N,N-dimethylmethanamine?
1-(5-ethyl-1,3,4-oxadiazol-2-yl)-N,N-dimethylmethanamine has a molecular weight of 155.20 g/mol, XLogP of 0.69, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-ethyl-1,3,4-oxadiazol-2-yl)-N,N-dimethylmethanamine is sourced from PubChem (CID 89036722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).