1-[1-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]piperidin-4-yl]-N-methylmethanamine

C12H22N4O — CID 55167770

IUPAC1-[1-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]piperidin-4-yl]-N-methylmethanamine
SMILESCCc1nnc(CN2CCC(CNC)CC2)o1
InChIInChI=1S/C12H22N4O/c1-3-11-14-15-12(17-11)9-16-6-4-10(5-7-16)8-13-2/h10,13H,3-9H2,1-2H3
InChIKeyZOAHGYDOEXSPAN-UHFFFAOYSA-N
MW238.33 g/mol
LogP1.06
Rot. Bonds5

About 1-[1-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]piperidin-4-yl]-N-methylmethanamine

1-[1-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]piperidin-4-yl]-N-methylmethanamine (PubChem CID 55167770) has the molecular formula C12H22N4O and a molecular weight of 238.33 g/mol. Its IUPAC name is 1-[1-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]piperidin-4-yl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[1-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]piperidin-4-yl]-N-methylmethanamine
PubChem CID55167770
Molecular FormulaC12H22N4O
Molecular Weight238.33 g/mol
Exact Mass238.18
IUPAC Name1-[1-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]piperidin-4-yl]-N-methylmethanamine
SMILESCCc1nnc(CN2CCC(CNC)CC2)o1
InChIInChI=1S/C12H22N4O/c1-3-11-14-15-12(17-11)9-16-6-4-10(5-7-16)8-13-2/h10,13H,3-9H2,1-2H3
InChIKeyZOAHGYDOEXSPAN-UHFFFAOYSA-N
XLogP1.06
TPSA54.19 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-[1-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]piperidin-4-yl]-N-methylmethanamine 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 1-[1-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]piperidin-4-yl]-N-methylmethanamine?
The IUPAC name of 1-[1-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]piperidin-4-yl]-N-methylmethanamine (CID 55167770) is 1-[1-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]piperidin-4-yl]-N-methylmethanamine.
What is the SMILES notation for 1-[1-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]piperidin-4-yl]-N-methylmethanamine?
The canonical SMILES for 1-[1-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]piperidin-4-yl]-N-methylmethanamine is CCc1nnc(CN2CCC(CNC)CC2)o1.
What is the InChIKey of 1-[1-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]piperidin-4-yl]-N-methylmethanamine?
The InChIKey is ZOAHGYDOEXSPAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4O/c1-3-11-14-15-12(17-11)9-16-6-4-10(5-7-16)8-13-2/h10,13H,3-9H2,1-2H3.
What are the key properties of 1-[1-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]piperidin-4-yl]-N-methylmethanamine?
1-[1-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]piperidin-4-yl]-N-methylmethanamine has a molecular weight of 238.33 g/mol, XLogP of 1.06, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]piperidin-4-yl]-N-methylmethanamine is sourced from PubChem (CID 55167770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).