2-cyclohexyl-2-methoxy-1-(5-propan-2-yloxy-3-pyridinyl)ethanamine

C17H28N2O2 — CID 116771301

IUPAC2-cyclohexyl-2-methoxy-1-(5-propan-2-yloxy-3-pyridinyl)ethanamine
SMILESCOC(C1CCCCC1)C(N)c1cncc(OC(C)C)c1
InChIInChI=1S/C17H28N2O2/c1-12(2)21-15-9-14(10-19-11-15)16(18)17(20-3)13-7-5-4-6-8-13/h9-13,16-17H,4-8,18H2,1-3H3
InChIKeyJDZVJFYVNAMANT-UHFFFAOYSA-N
MW292.42 g/mol
LogP3.46
Rot. Bonds6

About 2-cyclohexyl-2-methoxy-1-(5-propan-2-yloxy-3-pyridinyl)ethanamine

2-cyclohexyl-2-methoxy-1-(5-propan-2-yloxy-3-pyridinyl)ethanamine (PubChem CID 116771301) has the molecular formula C17H28N2O2 and a molecular weight of 292.42 g/mol. Its IUPAC name is 2-cyclohexyl-2-methoxy-1-(5-propan-2-yloxy-3-pyridinyl)ethanamine.

Molecular Properties

Compound Name2-cyclohexyl-2-methoxy-1-(5-propan-2-yloxy-3-pyridinyl)ethanamine
PubChem CID116771301
Molecular FormulaC17H28N2O2
Molecular Weight292.42 g/mol
Exact Mass292.22
IUPAC Name2-cyclohexyl-2-methoxy-1-(5-propan-2-yloxy-3-pyridinyl)ethanamine
SMILESCOC(C1CCCCC1)C(N)c1cncc(OC(C)C)c1
InChIInChI=1S/C17H28N2O2/c1-12(2)21-15-9-14(10-19-11-15)16(18)17(20-3)13-7-5-4-6-8-13/h9-13,16-17H,4-8,18H2,1-3H3
InChIKeyJDZVJFYVNAMANT-UHFFFAOYSA-N
XLogP3.46
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.42
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[2-cyclopropyl-2-methoxy-1-(5-propan-2-yloxy-3-pyridinyl)ethyl]hydrazine
CID 105272873
2-cyclopropyl-1-(5-fluoro-3-pyridinyl)-2-methoxyethanamine
CID 116722038
3-cyclopentyl-1-(5-propan-2-yloxy-3-pyridinyl)propan-1-amine
CID 105027507
2-methoxy-1-(5-propan-2-yloxy-3-pyridinyl)pentan-1-amine
CID 116718601
(2,2-dimethylcyclopentyl)-(5-propan-2-yloxy-3-pyridinyl)methanamine
CID 107190563
3-cyclohexyl-1-(5-propan-2-yloxy-3-pyridinyl)propan-1-ol
CID 115829399
2-cyclohexyl-1-(3-ethoxyphenyl)-2-methoxyethanamine
CID 116771298
(1-methoxy-4-methylcyclohexyl)-(5-propan-2-yloxy-3-pyridinyl)methanamine
CID 116766242
[cyclooctyl-(5-methoxy-3-pyridinyl)methyl]hydrazine
CID 105255257
piperidin-2-yl-(5-propan-2-yloxy-3-pyridinyl)methanol
CID 106634630
[2,2-dimethoxy-1-(5-propan-2-yloxy-3-pyridinyl)ethyl]hydrazine
CID 105246133
(5-propan-2-yloxy-3-pyridinyl)-pyrrolidin-2-ylmethanol
CID 106639944

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-2-methoxy-1-(5-propan-2-yloxy-3-pyridinyl)ethanamine?
The IUPAC name of 2-cyclohexyl-2-methoxy-1-(5-propan-2-yloxy-3-pyridinyl)ethanamine (CID 116771301) is 2-cyclohexyl-2-methoxy-1-(5-propan-2-yloxy-3-pyridinyl)ethanamine.
What is the SMILES notation for 2-cyclohexyl-2-methoxy-1-(5-propan-2-yloxy-3-pyridinyl)ethanamine?
The canonical SMILES for 2-cyclohexyl-2-methoxy-1-(5-propan-2-yloxy-3-pyridinyl)ethanamine is COC(C1CCCCC1)C(N)c1cncc(OC(C)C)c1.
What is the InChIKey of 2-cyclohexyl-2-methoxy-1-(5-propan-2-yloxy-3-pyridinyl)ethanamine?
The InChIKey is JDZVJFYVNAMANT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O2/c1-12(2)21-15-9-14(10-19-11-15)16(18)17(20-3)13-7-5-4-6-8-13/h9-13,16-17H,4-8,18H2,1-3H3.
What are the key properties of 2-cyclohexyl-2-methoxy-1-(5-propan-2-yloxy-3-pyridinyl)ethanamine?
2-cyclohexyl-2-methoxy-1-(5-propan-2-yloxy-3-pyridinyl)ethanamine has a molecular weight of 292.42 g/mol, XLogP of 3.46, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-2-methoxy-1-(5-propan-2-yloxy-3-pyridinyl)ethanamine is sourced from PubChem (CID 116771301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).