(1R)-1-[5-(4,4-dimethylcyclohexyl)oxy-2-pyridinyl]ethanamine

C15H24N2O — CID 104893945

IUPAC(1R)-1-[5-(4,4-dimethylcyclohexyl)oxy-2-pyridinyl]ethanamine
SMILESC[C@@H](N)c1ccc(OC2CCC(C)(C)CC2)cn1
InChIInChI=1S/C15H24N2O/c1-11(16)14-5-4-13(10-17-14)18-12-6-8-15(2,3)9-7-12/h4-5,10-12H,6-9,16H2,1-3H3/t11-/m1/s1
InChIKeyPDFYAUAKBOZZDO-LLVKDONJSA-N
MW248.37 g/mol
LogP3.45
Rot. Bonds3

About (1R)-1-[5-(4,4-dimethylcyclohexyl)oxy-2-pyridinyl]ethanamine

(1R)-1-[5-(4,4-dimethylcyclohexyl)oxy-2-pyridinyl]ethanamine (PubChem CID 104893945) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is (1R)-1-[5-(4,4-dimethylcyclohexyl)oxy-2-pyridinyl]ethanamine.

Molecular Properties

Compound Name(1R)-1-[5-(4,4-dimethylcyclohexyl)oxy-2-pyridinyl]ethanamine
PubChem CID104893945
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name(1R)-1-[5-(4,4-dimethylcyclohexyl)oxy-2-pyridinyl]ethanamine
SMILESC[C@@H](N)c1ccc(OC2CCC(C)(C)CC2)cn1
InChIInChI=1S/C15H24N2O/c1-11(16)14-5-4-13(10-17-14)18-12-6-8-15(2,3)9-7-12/h4-5,10-12H,6-9,16H2,1-3H3/t11-/m1/s1
InChIKeyPDFYAUAKBOZZDO-LLVKDONJSA-N
XLogP3.45
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (1R)-1-[5-(4,4-dimethylcyclohexyl)oxy-2-pyridinyl]ethanamine 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 (1R)-1-[5-(4,4-dimethylcyclohexyl)oxy-2-pyridinyl]ethanamine?
The IUPAC name of (1R)-1-[5-(4,4-dimethylcyclohexyl)oxy-2-pyridinyl]ethanamine (CID 104893945) is (1R)-1-[5-(4,4-dimethylcyclohexyl)oxy-2-pyridinyl]ethanamine.
What is the SMILES notation for (1R)-1-[5-(4,4-dimethylcyclohexyl)oxy-2-pyridinyl]ethanamine?
The canonical SMILES for (1R)-1-[5-(4,4-dimethylcyclohexyl)oxy-2-pyridinyl]ethanamine is C[C@@H](N)c1ccc(OC2CCC(C)(C)CC2)cn1.
What is the InChIKey of (1R)-1-[5-(4,4-dimethylcyclohexyl)oxy-2-pyridinyl]ethanamine?
The InChIKey is PDFYAUAKBOZZDO-LLVKDONJSA-N. The full InChI is InChI=1S/C15H24N2O/c1-11(16)14-5-4-13(10-17-14)18-12-6-8-15(2,3)9-7-12/h4-5,10-12H,6-9,16H2,1-3H3/t11-/m1/s1.
What are the key properties of (1R)-1-[5-(4,4-dimethylcyclohexyl)oxy-2-pyridinyl]ethanamine?
(1R)-1-[5-(4,4-dimethylcyclohexyl)oxy-2-pyridinyl]ethanamine has a molecular weight of 248.37 g/mol, XLogP of 3.45, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[5-(4,4-dimethylcyclohexyl)oxy-2-pyridinyl]ethanamine is sourced from PubChem (CID 104893945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).