2-methyl-6-propoxy-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-4-amine

C17H30N4O — CID 82453995

IUPAC2-methyl-6-propoxy-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-4-amine
SMILESCCCOc1cc(NC2CC(C)(C)NC(C)(C)C2)nc(C)n1
InChIInChI=1S/C17H30N4O/c1-7-8-22-15-9-14(18-12(2)19-15)20-13-10-16(3,4)21-17(5,6)11-13/h9,13,21H,7-8,10-11H2,1-6H3,(H,18,19,20)
InChIKeyGGHNCURQHPIWTE-UHFFFAOYSA-N
MW306.45 g/mol
LogP3.29
Rot. Bonds5

About 2-methyl-6-propoxy-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-4-amine

2-methyl-6-propoxy-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-4-amine (PubChem CID 82453995) has the molecular formula C17H30N4O and a molecular weight of 306.45 g/mol. Its IUPAC name is 2-methyl-6-propoxy-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-4-amine.

Molecular Properties

Compound Name2-methyl-6-propoxy-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-4-amine
PubChem CID82453995
Molecular FormulaC17H30N4O
Molecular Weight306.45 g/mol
Exact Mass306.24
IUPAC Name2-methyl-6-propoxy-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-4-amine
SMILESCCCOc1cc(NC2CC(C)(C)NC(C)(C)C2)nc(C)n1
InChIInChI=1S/C17H30N4O/c1-7-8-22-15-9-14(18-12(2)19-15)20-13-10-16(3,4)21-17(5,6)11-13/h9,13,21H,7-8,10-11H2,1-6H3,(H,18,19,20)
InChIKeyGGHNCURQHPIWTE-UHFFFAOYSA-N
XLogP3.29
TPSA59.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.45
LogP ≤ 53.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-methyl-6-propoxy-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-4-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 2-methyl-6-propoxy-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-4-amine?
The IUPAC name of 2-methyl-6-propoxy-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-4-amine (CID 82453995) is 2-methyl-6-propoxy-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-4-amine.
What is the SMILES notation for 2-methyl-6-propoxy-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-4-amine?
The canonical SMILES for 2-methyl-6-propoxy-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-4-amine is CCCOc1cc(NC2CC(C)(C)NC(C)(C)C2)nc(C)n1.
What is the InChIKey of 2-methyl-6-propoxy-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-4-amine?
The InChIKey is GGHNCURQHPIWTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N4O/c1-7-8-22-15-9-14(18-12(2)19-15)20-13-10-16(3,4)21-17(5,6)11-13/h9,13,21H,7-8,10-11H2,1-6H3,(H,18,19,20).
What are the key properties of 2-methyl-6-propoxy-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-4-amine?
2-methyl-6-propoxy-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-4-amine has a molecular weight of 306.45 g/mol, XLogP of 3.29, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-propoxy-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-4-amine is sourced from PubChem (CID 82453995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).