4-chloro-N-(2-morpholin-4-ylethyl)-6-piperidin-1-yl-1,3,5-triazin-2-amine

C14H23ClN6O — CID 692002

IUPAC4-chloro-N-(2-morpholin-4-ylethyl)-6-piperidin-1-yl-1,3,5-triazin-2-amine
SMILESClc1nc(NCCN2CCOCC2)nc(N2CCCCC2)n1
InChIInChI=1S/C14H23ClN6O/c15-12-17-13(16-4-7-20-8-10-22-11-9-20)19-14(18-12)21-5-2-1-3-6-21/h1-11H2,(H,16,17,18,19)
InChIKeyLKDCYGLJXUONAL-UHFFFAOYSA-N
MW326.83 g/mol
LogP1.26
Rot. Bonds5

About 4-chloro-N-(2-morpholin-4-ylethyl)-6-piperidin-1-yl-1,3,5-triazin-2-amine

4-chloro-N-(2-morpholin-4-ylethyl)-6-piperidin-1-yl-1,3,5-triazin-2-amine (PubChem CID 692002) has the molecular formula C14H23ClN6O and a molecular weight of 326.83 g/mol. Its IUPAC name is 4-chloro-N-(2-morpholin-4-ylethyl)-6-piperidin-1-yl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-chloro-N-(2-morpholin-4-ylethyl)-6-piperidin-1-yl-1,3,5-triazin-2-amine
PubChem CID692002
Molecular FormulaC14H23ClN6O
Molecular Weight326.83 g/mol
Exact Mass326.16
IUPAC Name4-chloro-N-(2-morpholin-4-ylethyl)-6-piperidin-1-yl-1,3,5-triazin-2-amine
SMILESClc1nc(NCCN2CCOCC2)nc(N2CCCCC2)n1
InChIInChI=1S/C14H23ClN6O/c15-12-17-13(16-4-7-20-8-10-22-11-9-20)19-14(18-12)21-5-2-1-3-6-21/h1-11H2,(H,16,17,18,19)
InChIKeyLKDCYGLJXUONAL-UHFFFAOYSA-N
XLogP1.26
TPSA66.41 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.83
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 4-chloro-N-(2-morpholin-4-ylethyl)-6-piperidin-1-yl-1,3,5-triazin-2-amine 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 4-chloro-N-(2-morpholin-4-ylethyl)-6-piperidin-1-yl-1,3,5-triazin-2-amine?
The IUPAC name of 4-chloro-N-(2-morpholin-4-ylethyl)-6-piperidin-1-yl-1,3,5-triazin-2-amine (CID 692002) is 4-chloro-N-(2-morpholin-4-ylethyl)-6-piperidin-1-yl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-chloro-N-(2-morpholin-4-ylethyl)-6-piperidin-1-yl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-chloro-N-(2-morpholin-4-ylethyl)-6-piperidin-1-yl-1,3,5-triazin-2-amine is Clc1nc(NCCN2CCOCC2)nc(N2CCCCC2)n1.
What is the InChIKey of 4-chloro-N-(2-morpholin-4-ylethyl)-6-piperidin-1-yl-1,3,5-triazin-2-amine?
The InChIKey is LKDCYGLJXUONAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23ClN6O/c15-12-17-13(16-4-7-20-8-10-22-11-9-20)19-14(18-12)21-5-2-1-3-6-21/h1-11H2,(H,16,17,18,19).
What are the key properties of 4-chloro-N-(2-morpholin-4-ylethyl)-6-piperidin-1-yl-1,3,5-triazin-2-amine?
4-chloro-N-(2-morpholin-4-ylethyl)-6-piperidin-1-yl-1,3,5-triazin-2-amine has a molecular weight of 326.83 g/mol, XLogP of 1.26, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-(2-morpholin-4-ylethyl)-6-piperidin-1-yl-1,3,5-triazin-2-amine is sourced from PubChem (CID 692002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).