4-chloro-5,6-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-2-amine

C15H25ClN4 — CID 82461001

IUPAC4-chloro-5,6-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-2-amine
SMILESCc1nc(NC2CC(C)(C)NC(C)(C)C2)nc(Cl)c1C
InChIInChI=1S/C15H25ClN4/c1-9-10(2)17-13(19-12(9)16)18-11-7-14(3,4)20-15(5,6)8-11/h11,20H,7-8H2,1-6H3,(H,17,18,19)
InChIKeyYWGNJWXUEQJQIJ-UHFFFAOYSA-N
MW296.85 g/mol
LogP3.47
Rot. Bonds2

About 4-chloro-5,6-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-2-amine

4-chloro-5,6-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-2-amine (PubChem CID 82461001) has the molecular formula C15H25ClN4 and a molecular weight of 296.85 g/mol. Its IUPAC name is 4-chloro-5,6-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-2-amine.

Molecular Properties

Compound Name4-chloro-5,6-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-2-amine
PubChem CID82461001
Molecular FormulaC15H25ClN4
Molecular Weight296.85 g/mol
Exact Mass296.18
IUPAC Name4-chloro-5,6-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-2-amine
SMILESCc1nc(NC2CC(C)(C)NC(C)(C)C2)nc(Cl)c1C
InChIInChI=1S/C15H25ClN4/c1-9-10(2)17-13(19-12(9)16)18-11-7-14(3,4)20-15(5,6)8-11/h11,20H,7-8H2,1-6H3,(H,17,18,19)
InChIKeyYWGNJWXUEQJQIJ-UHFFFAOYSA-N
XLogP3.47
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.85
LogP ≤ 53.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-chloro-5,6-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-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-5,6-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-2-amine?
The IUPAC name of 4-chloro-5,6-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-2-amine (CID 82461001) is 4-chloro-5,6-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-2-amine.
What is the SMILES notation for 4-chloro-5,6-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-2-amine?
The canonical SMILES for 4-chloro-5,6-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-2-amine is Cc1nc(NC2CC(C)(C)NC(C)(C)C2)nc(Cl)c1C.
What is the InChIKey of 4-chloro-5,6-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-2-amine?
The InChIKey is YWGNJWXUEQJQIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25ClN4/c1-9-10(2)17-13(19-12(9)16)18-11-7-14(3,4)20-15(5,6)8-11/h11,20H,7-8H2,1-6H3,(H,17,18,19).
What are the key properties of 4-chloro-5,6-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-2-amine?
4-chloro-5,6-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-2-amine has a molecular weight of 296.85 g/mol, XLogP of 3.47, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-5,6-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-2-amine is sourced from PubChem (CID 82461001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).