2-(4-ethoxyphenyl)-N-methyl-2-propan-2-yloxyethanamine

C14H23NO2 — CID 53276270

IUPAC2-(4-ethoxyphenyl)-N-methyl-2-propan-2-yloxyethanamine
SMILESCCOc1ccc(C(CNC)OC(C)C)cc1
InChIInChI=1S/C14H23NO2/c1-5-16-13-8-6-12(7-9-13)14(10-15-4)17-11(2)3/h6-9,11,14-15H,5,10H2,1-4H3
InChIKeyFAKLBYIHDRUDHU-UHFFFAOYSA-N
MW237.34 g/mol
LogP2.77
Rot. Bonds7

About 2-(4-ethoxyphenyl)-N-methyl-2-propan-2-yloxyethanamine

2-(4-ethoxyphenyl)-N-methyl-2-propan-2-yloxyethanamine (PubChem CID 53276270) has the molecular formula C14H23NO2 and a molecular weight of 237.34 g/mol. Its IUPAC name is 2-(4-ethoxyphenyl)-N-methyl-2-propan-2-yloxyethanamine.

Molecular Properties

Compound Name2-(4-ethoxyphenyl)-N-methyl-2-propan-2-yloxyethanamine
PubChem CID53276270
Molecular FormulaC14H23NO2
Molecular Weight237.34 g/mol
Exact Mass237.17
IUPAC Name2-(4-ethoxyphenyl)-N-methyl-2-propan-2-yloxyethanamine
SMILESCCOc1ccc(C(CNC)OC(C)C)cc1
InChIInChI=1S/C14H23NO2/c1-5-16-13-8-6-12(7-9-13)14(10-15-4)17-11(2)3/h6-9,11,14-15H,5,10H2,1-4H3
InChIKeyFAKLBYIHDRUDHU-UHFFFAOYSA-N
XLogP2.77
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.34
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-methoxyphenyl)-N-methyl-2-propan-2-yloxyethanamine
CID 53276269
2-(4-ethylphenyl)-N-methyl-2-propan-2-yloxyethanamine
CID 53276085
2-(1-ethoxypropan-2-yloxy)-2-(4-methoxyphenyl)-N-methylethanamine
CID 103490183
(4-ethoxyphenyl)-(methylamino)methanol
CID 116954646
1-(4-ethoxyphenyl)-N,5-dimethylhexan-1-amine
CID 105028805
1-(4-ethoxyphenyl)-3-(methylamino)propan-1-ol
CID 112509819
N-[1-(4-ethoxyphenyl)ethyl]-4-methylpentan-1-amine
CID 54914008
[(1S)-1-(4-ethoxyphenyl)ethyl]azanium chloride
CID 89251854
1-(4-ethoxyphenyl)-N-methylpentan-1-amine
CID 43481859
N-[1-(4-ethoxyphenyl)ethyl]-2-methylbutan-1-amine
CID 43734730
2-(4-ethoxyphenyl)propanedial
CID 3698706
1-ethoxy-4-(4-methylpentan-2-yl)benzene
CID 57011514

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethoxyphenyl)-N-methyl-2-propan-2-yloxyethanamine?
The IUPAC name of 2-(4-ethoxyphenyl)-N-methyl-2-propan-2-yloxyethanamine (CID 53276270) is 2-(4-ethoxyphenyl)-N-methyl-2-propan-2-yloxyethanamine.
What is the SMILES notation for 2-(4-ethoxyphenyl)-N-methyl-2-propan-2-yloxyethanamine?
The canonical SMILES for 2-(4-ethoxyphenyl)-N-methyl-2-propan-2-yloxyethanamine is CCOc1ccc(C(CNC)OC(C)C)cc1.
What is the InChIKey of 2-(4-ethoxyphenyl)-N-methyl-2-propan-2-yloxyethanamine?
The InChIKey is FAKLBYIHDRUDHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO2/c1-5-16-13-8-6-12(7-9-13)14(10-15-4)17-11(2)3/h6-9,11,14-15H,5,10H2,1-4H3.
What are the key properties of 2-(4-ethoxyphenyl)-N-methyl-2-propan-2-yloxyethanamine?
2-(4-ethoxyphenyl)-N-methyl-2-propan-2-yloxyethanamine has a molecular weight of 237.34 g/mol, XLogP of 2.77, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethoxyphenyl)-N-methyl-2-propan-2-yloxyethanamine is sourced from PubChem (CID 53276270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).