2-(4-ethoxy-2-methylphenyl)-2-(2-methylcyclohexyl)ethanamine

C18H29NO — CID 83974256

IUPAC2-(4-ethoxy-2-methylphenyl)-2-(2-methylcyclohexyl)ethanamine
SMILESCCOc1ccc(C(CN)C2CCCCC2C)c(C)c1
InChIInChI=1S/C18H29NO/c1-4-20-15-9-10-17(14(3)11-15)18(12-19)16-8-6-5-7-13(16)2/h9-11,13,16,18H,4-8,12,19H2,1-3H3
InChIKeyPGXQCSDPBADDEW-UHFFFAOYSA-N
MW275.44 g/mol
LogP4.26
Rot. Bonds5

About 2-(4-ethoxy-2-methylphenyl)-2-(2-methylcyclohexyl)ethanamine

2-(4-ethoxy-2-methylphenyl)-2-(2-methylcyclohexyl)ethanamine (PubChem CID 83974256) has the molecular formula C18H29NO and a molecular weight of 275.44 g/mol. Its IUPAC name is 2-(4-ethoxy-2-methylphenyl)-2-(2-methylcyclohexyl)ethanamine.

Molecular Properties

Compound Name2-(4-ethoxy-2-methylphenyl)-2-(2-methylcyclohexyl)ethanamine
PubChem CID83974256
Molecular FormulaC18H29NO
Molecular Weight275.44 g/mol
Exact Mass275.22
IUPAC Name2-(4-ethoxy-2-methylphenyl)-2-(2-methylcyclohexyl)ethanamine
SMILESCCOc1ccc(C(CN)C2CCCCC2C)c(C)c1
InChIInChI=1S/C18H29NO/c1-4-20-15-9-10-17(14(3)11-15)18(12-19)16-8-6-5-7-13(16)2/h9-11,13,16,18H,4-8,12,19H2,1-3H3
InChIKeyPGXQCSDPBADDEW-UHFFFAOYSA-N
XLogP4.26
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.44
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-ethoxy-2-methylphenyl)-2-(3-methylcyclohexyl)ethanamine
CID 83974266
2-(4-ethoxy-2-methylphenyl)-2-(1-propylpiperidin-4-yl)ethanamine
CID 83974261
2-[2-(4-ethoxy-2-methylphenyl)butyl]-3-methyloxirane
CID 83936677
2-cyclopentyl-2-(3-ethoxyphenyl)ethanamine
CID 83973259
2-(5-fluoro-2-methoxyphenyl)-2-(2-methylcyclohexyl)ethanamine
CID 83974794
2-(4-ethoxy-2-methylphenyl)-3-(3-methylthiophen-2-yl)propan-1-amine
CID 83974291
2-(4-ethoxy-2-methylphenyl)-3-(3-fluorophenyl)propan-1-amine
CID 83974319
N-[(2-bromo-4-ethoxyphenyl)-(2-methylcyclopentyl)methyl]ethanamine
CID 107178004
2-(4-chloro-2-methylphenyl)-2-cyclopentylethanamine
CID 83824559
2-[2-(2-methyl-4-propoxyphenyl)butyl]propane-1,3-diamine
CID 83936840
2-(4-ethoxy-2-methylphenyl)-3-(1-methylindol-3-yl)propan-1-amine
CID 83974313
2-cyclohexyl-2-(2-ethoxy-5-methylphenyl)ethanamine
CID 83974493

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethoxy-2-methylphenyl)-2-(2-methylcyclohexyl)ethanamine?
The IUPAC name of 2-(4-ethoxy-2-methylphenyl)-2-(2-methylcyclohexyl)ethanamine (CID 83974256) is 2-(4-ethoxy-2-methylphenyl)-2-(2-methylcyclohexyl)ethanamine.
What is the SMILES notation for 2-(4-ethoxy-2-methylphenyl)-2-(2-methylcyclohexyl)ethanamine?
The canonical SMILES for 2-(4-ethoxy-2-methylphenyl)-2-(2-methylcyclohexyl)ethanamine is CCOc1ccc(C(CN)C2CCCCC2C)c(C)c1.
What is the InChIKey of 2-(4-ethoxy-2-methylphenyl)-2-(2-methylcyclohexyl)ethanamine?
The InChIKey is PGXQCSDPBADDEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29NO/c1-4-20-15-9-10-17(14(3)11-15)18(12-19)16-8-6-5-7-13(16)2/h9-11,13,16,18H,4-8,12,19H2,1-3H3.
What are the key properties of 2-(4-ethoxy-2-methylphenyl)-2-(2-methylcyclohexyl)ethanamine?
2-(4-ethoxy-2-methylphenyl)-2-(2-methylcyclohexyl)ethanamine has a molecular weight of 275.44 g/mol, XLogP of 4.26, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethoxy-2-methylphenyl)-2-(2-methylcyclohexyl)ethanamine is sourced from PubChem (CID 83974256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).