1-[2-(2-ethylcyclohexyl)oxy-3-pyridinyl]-N-methylmethanamine

C15H24N2O — CID 62289951

IUPAC1-[2-(2-ethylcyclohexyl)oxy-3-pyridinyl]-N-methylmethanamine
SMILESCCC1CCCCC1Oc1ncccc1CNC
InChIInChI=1S/C15H24N2O/c1-3-12-7-4-5-9-14(12)18-15-13(11-16-2)8-6-10-17-15/h6,8,10,12,14,16H,3-5,7,9,11H2,1-2H3
InChIKeyJUFXPLBQHJWZDO-UHFFFAOYSA-N
MW248.37 g/mol
LogP3.15
Rot. Bonds5

About 1-[2-(2-ethylcyclohexyl)oxy-3-pyridinyl]-N-methylmethanamine

1-[2-(2-ethylcyclohexyl)oxy-3-pyridinyl]-N-methylmethanamine (PubChem CID 62289951) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 1-[2-(2-ethylcyclohexyl)oxy-3-pyridinyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[2-(2-ethylcyclohexyl)oxy-3-pyridinyl]-N-methylmethanamine
PubChem CID62289951
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name1-[2-(2-ethylcyclohexyl)oxy-3-pyridinyl]-N-methylmethanamine
SMILESCCC1CCCCC1Oc1ncccc1CNC
InChIInChI=1S/C15H24N2O/c1-3-12-7-4-5-9-14(12)18-15-13(11-16-2)8-6-10-17-15/h6,8,10,12,14,16H,3-5,7,9,11H2,1-2H3
InChIKeyJUFXPLBQHJWZDO-UHFFFAOYSA-N
XLogP3.15
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-ethylcyclohexyl)oxy-3-pyridinyl]-N-methylmethanamine?
The IUPAC name of 1-[2-(2-ethylcyclohexyl)oxy-3-pyridinyl]-N-methylmethanamine (CID 62289951) is 1-[2-(2-ethylcyclohexyl)oxy-3-pyridinyl]-N-methylmethanamine.
What is the SMILES notation for 1-[2-(2-ethylcyclohexyl)oxy-3-pyridinyl]-N-methylmethanamine?
The canonical SMILES for 1-[2-(2-ethylcyclohexyl)oxy-3-pyridinyl]-N-methylmethanamine is CCC1CCCCC1Oc1ncccc1CNC.
What is the InChIKey of 1-[2-(2-ethylcyclohexyl)oxy-3-pyridinyl]-N-methylmethanamine?
The InChIKey is JUFXPLBQHJWZDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-3-12-7-4-5-9-14(12)18-15-13(11-16-2)8-6-10-17-15/h6,8,10,12,14,16H,3-5,7,9,11H2,1-2H3.
What are the key properties of 1-[2-(2-ethylcyclohexyl)oxy-3-pyridinyl]-N-methylmethanamine?
1-[2-(2-ethylcyclohexyl)oxy-3-pyridinyl]-N-methylmethanamine has a molecular weight of 248.37 g/mol, XLogP of 3.15, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-ethylcyclohexyl)oxy-3-pyridinyl]-N-methylmethanamine is sourced from PubChem (CID 62289951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).