1-[3-chloro-6-(4-ethyl-4-methylpiperidin-1-yl)-2-pyridinyl]-N-methylmethanamine

C15H24ClN3 — CID 63159789

IUPAC1-[3-chloro-6-(4-ethyl-4-methylpiperidin-1-yl)-2-pyridinyl]-N-methylmethanamine
SMILESCCC1(C)CCN(c2ccc(Cl)c(CNC)n2)CC1
InChIInChI=1S/C15H24ClN3/c1-4-15(2)7-9-19(10-8-15)14-6-5-12(16)13(18-14)11-17-3/h5-6,17H,4,7-11H2,1-3H3
InChIKeyBSUPITXWPXYHCO-UHFFFAOYSA-N
MW281.83 g/mol
LogP3.47
Rot. Bonds4

About 1-[3-chloro-6-(4-ethyl-4-methylpiperidin-1-yl)-2-pyridinyl]-N-methylmethanamine

1-[3-chloro-6-(4-ethyl-4-methylpiperidin-1-yl)-2-pyridinyl]-N-methylmethanamine (PubChem CID 63159789) has the molecular formula C15H24ClN3 and a molecular weight of 281.83 g/mol. Its IUPAC name is 1-[3-chloro-6-(4-ethyl-4-methylpiperidin-1-yl)-2-pyridinyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[3-chloro-6-(4-ethyl-4-methylpiperidin-1-yl)-2-pyridinyl]-N-methylmethanamine
PubChem CID63159789
Molecular FormulaC15H24ClN3
Molecular Weight281.83 g/mol
Exact Mass281.17
IUPAC Name1-[3-chloro-6-(4-ethyl-4-methylpiperidin-1-yl)-2-pyridinyl]-N-methylmethanamine
SMILESCCC1(C)CCN(c2ccc(Cl)c(CNC)n2)CC1
InChIInChI=1S/C15H24ClN3/c1-4-15(2)7-9-19(10-8-15)14-6-5-12(16)13(18-14)11-17-3/h5-6,17H,4,7-11H2,1-3H3
InChIKeyBSUPITXWPXYHCO-UHFFFAOYSA-N
XLogP3.47
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.83
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[3-chloro-6-(4-ethyl-4-methylpiperidin-1-yl)-2-pyridinyl]-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-[3-chloro-6-(4-ethyl-4-methylpiperidin-1-yl)-2-pyridinyl]-N-methylmethanamine?
The IUPAC name of 1-[3-chloro-6-(4-ethyl-4-methylpiperidin-1-yl)-2-pyridinyl]-N-methylmethanamine (CID 63159789) is 1-[3-chloro-6-(4-ethyl-4-methylpiperidin-1-yl)-2-pyridinyl]-N-methylmethanamine.
What is the SMILES notation for 1-[3-chloro-6-(4-ethyl-4-methylpiperidin-1-yl)-2-pyridinyl]-N-methylmethanamine?
The canonical SMILES for 1-[3-chloro-6-(4-ethyl-4-methylpiperidin-1-yl)-2-pyridinyl]-N-methylmethanamine is CCC1(C)CCN(c2ccc(Cl)c(CNC)n2)CC1.
What is the InChIKey of 1-[3-chloro-6-(4-ethyl-4-methylpiperidin-1-yl)-2-pyridinyl]-N-methylmethanamine?
The InChIKey is BSUPITXWPXYHCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24ClN3/c1-4-15(2)7-9-19(10-8-15)14-6-5-12(16)13(18-14)11-17-3/h5-6,17H,4,7-11H2,1-3H3.
What are the key properties of 1-[3-chloro-6-(4-ethyl-4-methylpiperidin-1-yl)-2-pyridinyl]-N-methylmethanamine?
1-[3-chloro-6-(4-ethyl-4-methylpiperidin-1-yl)-2-pyridinyl]-N-methylmethanamine has a molecular weight of 281.83 g/mol, XLogP of 3.47, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-chloro-6-(4-ethyl-4-methylpiperidin-1-yl)-2-pyridinyl]-N-methylmethanamine is sourced from PubChem (CID 63159789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).