N-(2-cyclohexylethyl)-5-methoxy-2-methylpyridin-4-amine

C15H24N2O — CID 106660313

IUPACN-(2-cyclohexylethyl)-5-methoxy-2-methylpyridin-4-amine
SMILESCOc1cnc(C)cc1NCCC1CCCCC1
InChIInChI=1S/C15H24N2O/c1-12-10-14(15(18-2)11-17-12)16-9-8-13-6-4-3-5-7-13/h10-11,13H,3-9H2,1-2H3,(H,16,17)
InChIKeyJLIIJJYTROPASY-UHFFFAOYSA-N
MW248.37 g/mol
LogP3.78
Rot. Bonds5

About N-(2-cyclohexylethyl)-5-methoxy-2-methylpyridin-4-amine

N-(2-cyclohexylethyl)-5-methoxy-2-methylpyridin-4-amine (PubChem CID 106660313) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is N-(2-cyclohexylethyl)-5-methoxy-2-methylpyridin-4-amine.

Molecular Properties

Compound NameN-(2-cyclohexylethyl)-5-methoxy-2-methylpyridin-4-amine
PubChem CID106660313
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC NameN-(2-cyclohexylethyl)-5-methoxy-2-methylpyridin-4-amine
SMILESCOc1cnc(C)cc1NCCC1CCCCC1
InChIInChI=1S/C15H24N2O/c1-12-10-14(15(18-2)11-17-12)16-9-8-13-6-4-3-5-7-13/h10-11,13H,3-9H2,1-2H3,(H,16,17)
InChIKeyJLIIJJYTROPASY-UHFFFAOYSA-N
XLogP3.78
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 ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-cyclohexylethyl)-5-methoxy-2-methylpyridin-4-amine?
The IUPAC name of N-(2-cyclohexylethyl)-5-methoxy-2-methylpyridin-4-amine (CID 106660313) is N-(2-cyclohexylethyl)-5-methoxy-2-methylpyridin-4-amine.
What is the SMILES notation for N-(2-cyclohexylethyl)-5-methoxy-2-methylpyridin-4-amine?
The canonical SMILES for N-(2-cyclohexylethyl)-5-methoxy-2-methylpyridin-4-amine is COc1cnc(C)cc1NCCC1CCCCC1.
What is the InChIKey of N-(2-cyclohexylethyl)-5-methoxy-2-methylpyridin-4-amine?
The InChIKey is JLIIJJYTROPASY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-12-10-14(15(18-2)11-17-12)16-9-8-13-6-4-3-5-7-13/h10-11,13H,3-9H2,1-2H3,(H,16,17).
What are the key properties of N-(2-cyclohexylethyl)-5-methoxy-2-methylpyridin-4-amine?
N-(2-cyclohexylethyl)-5-methoxy-2-methylpyridin-4-amine has a molecular weight of 248.37 g/mol, XLogP of 3.78, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclohexylethyl)-5-methoxy-2-methylpyridin-4-amine is sourced from PubChem (CID 106660313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).