N,N-dimethyl-2-[5-(2-piperidin-4-yloxyethyl)-1,2,4-oxadiazol-3-yl]ethanamine

C13H24N4O2 — CID 115345496

IUPACN,N-dimethyl-2-[5-(2-piperidin-4-yloxyethyl)-1,2,4-oxadiazol-3-yl]ethanamine
SMILESCN(C)CCc1noc(CCOC2CCNCC2)n1
InChIInChI=1S/C13H24N4O2/c1-17(2)9-5-12-15-13(19-16-12)6-10-18-11-3-7-14-8-4-11/h11,14H,3-10H2,1-2H3
InChIKeyKICZMWYDZMYQHS-UHFFFAOYSA-N
MW268.36 g/mol
LogP0.48
Rot. Bonds7

About N,N-dimethyl-2-[5-(2-piperidin-4-yloxyethyl)-1,2,4-oxadiazol-3-yl]ethanamine

N,N-dimethyl-2-[5-(2-piperidin-4-yloxyethyl)-1,2,4-oxadiazol-3-yl]ethanamine (PubChem CID 115345496) has the molecular formula C13H24N4O2 and a molecular weight of 268.36 g/mol. Its IUPAC name is N,N-dimethyl-2-[5-(2-piperidin-4-yloxyethyl)-1,2,4-oxadiazol-3-yl]ethanamine.

Molecular Properties

Compound NameN,N-dimethyl-2-[5-(2-piperidin-4-yloxyethyl)-1,2,4-oxadiazol-3-yl]ethanamine
PubChem CID115345496
Molecular FormulaC13H24N4O2
Molecular Weight268.36 g/mol
Exact Mass268.19
IUPAC NameN,N-dimethyl-2-[5-(2-piperidin-4-yloxyethyl)-1,2,4-oxadiazol-3-yl]ethanamine
SMILESCN(C)CCc1noc(CCOC2CCNCC2)n1
InChIInChI=1S/C13H24N4O2/c1-17(2)9-5-12-15-13(19-16-12)6-10-18-11-3-7-14-8-4-11/h11,14H,3-10H2,1-2H3
InChIKeyKICZMWYDZMYQHS-UHFFFAOYSA-N
XLogP0.48
TPSA63.42 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 50.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N,N-dimethyl-2-[5-(2-piperidin-4-yloxyethyl)-1,2,4-oxadiazol-3-yl]ethanamine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-[5-(2-piperidin-4-yloxyethyl)-1,2,4-oxadiazol-3-yl]ethanamine?
The IUPAC name of N,N-dimethyl-2-[5-(2-piperidin-4-yloxyethyl)-1,2,4-oxadiazol-3-yl]ethanamine (CID 115345496) is N,N-dimethyl-2-[5-(2-piperidin-4-yloxyethyl)-1,2,4-oxadiazol-3-yl]ethanamine.
What is the SMILES notation for N,N-dimethyl-2-[5-(2-piperidin-4-yloxyethyl)-1,2,4-oxadiazol-3-yl]ethanamine?
The canonical SMILES for N,N-dimethyl-2-[5-(2-piperidin-4-yloxyethyl)-1,2,4-oxadiazol-3-yl]ethanamine is CN(C)CCc1noc(CCOC2CCNCC2)n1.
What is the InChIKey of N,N-dimethyl-2-[5-(2-piperidin-4-yloxyethyl)-1,2,4-oxadiazol-3-yl]ethanamine?
The InChIKey is KICZMWYDZMYQHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N4O2/c1-17(2)9-5-12-15-13(19-16-12)6-10-18-11-3-7-14-8-4-11/h11,14H,3-10H2,1-2H3.
What are the key properties of N,N-dimethyl-2-[5-(2-piperidin-4-yloxyethyl)-1,2,4-oxadiazol-3-yl]ethanamine?
N,N-dimethyl-2-[5-(2-piperidin-4-yloxyethyl)-1,2,4-oxadiazol-3-yl]ethanamine has a molecular weight of 268.36 g/mol, XLogP of 0.48, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-[5-(2-piperidin-4-yloxyethyl)-1,2,4-oxadiazol-3-yl]ethanamine is sourced from PubChem (CID 115345496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).