N-butyl-4,6-dichloro-N-(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazin-2-amine

C17H29Cl2N5O — CID 10916139

IUPACN-butyl-4,6-dichloro-N-(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazin-2-amine
SMILESCCCCN(c1nc(Cl)nc(Cl)n1)C1CC(C)(C)N(OC)C(C)(C)C1
InChIInChI=1S/C17H29Cl2N5O/c1-7-8-9-23(15-21-13(18)20-14(19)22-15)12-10-16(2,3)24(25-6)17(4,5)11-12/h12H,7-11H2,1-6H3
InChIKeyHXZCYCANLMOPBM-UHFFFAOYSA-N
MW390.36 g/mol
LogP4.37
Rot. Bonds6

About N-butyl-4,6-dichloro-N-(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazin-2-amine

N-butyl-4,6-dichloro-N-(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazin-2-amine (PubChem CID 10916139) has the molecular formula C17H29Cl2N5O and a molecular weight of 390.36 g/mol. Its IUPAC name is N-butyl-4,6-dichloro-N-(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazin-2-amine.

Molecular Properties

Compound NameN-butyl-4,6-dichloro-N-(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazin-2-amine
PubChem CID10916139
Molecular FormulaC17H29Cl2N5O
Molecular Weight390.36 g/mol
Exact Mass389.17
IUPAC NameN-butyl-4,6-dichloro-N-(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazin-2-amine
SMILESCCCCN(c1nc(Cl)nc(Cl)n1)C1CC(C)(C)N(OC)C(C)(C)C1
InChIInChI=1S/C17H29Cl2N5O/c1-7-8-9-23(15-21-13(18)20-14(19)22-15)12-10-16(2,3)24(25-6)17(4,5)11-12/h12H,7-11H2,1-6H3
InChIKeyHXZCYCANLMOPBM-UHFFFAOYSA-N
XLogP4.37
TPSA54.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.36
LogP ≤ 54.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze N-butyl-4,6-dichloro-N-(1-methoxy-2,2,6,6-tetramethylpiperidin-4-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 N-butyl-4,6-dichloro-N-(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazin-2-amine?
The IUPAC name of N-butyl-4,6-dichloro-N-(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazin-2-amine (CID 10916139) is N-butyl-4,6-dichloro-N-(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazin-2-amine.
What is the SMILES notation for N-butyl-4,6-dichloro-N-(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazin-2-amine?
The canonical SMILES for N-butyl-4,6-dichloro-N-(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazin-2-amine is CCCCN(c1nc(Cl)nc(Cl)n1)C1CC(C)(C)N(OC)C(C)(C)C1.
What is the InChIKey of N-butyl-4,6-dichloro-N-(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazin-2-amine?
The InChIKey is HXZCYCANLMOPBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29Cl2N5O/c1-7-8-9-23(15-21-13(18)20-14(19)22-15)12-10-16(2,3)24(25-6)17(4,5)11-12/h12H,7-11H2,1-6H3.
What are the key properties of N-butyl-4,6-dichloro-N-(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazin-2-amine?
N-butyl-4,6-dichloro-N-(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazin-2-amine has a molecular weight of 390.36 g/mol, XLogP of 4.37, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-4,6-dichloro-N-(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazin-2-amine is sourced from PubChem (CID 10916139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).