2-ethoxy-2-(4-propan-2-yloxyphenyl)ethanamine

C13H21NO2 — CID 66072366

IUPAC2-ethoxy-2-(4-propan-2-yloxyphenyl)ethanamine
SMILESCCOC(CN)c1ccc(OC(C)C)cc1
InChIInChI=1S/C13H21NO2/c1-4-15-13(9-14)11-5-7-12(8-6-11)16-10(2)3/h5-8,10,13H,4,9,14H2,1-3H3
InChIKeyIEJFLPLSDIJOJA-UHFFFAOYSA-N
MW223.32 g/mol
LogP2.51
Rot. Bonds6

About 2-ethoxy-2-(4-propan-2-yloxyphenyl)ethanamine

2-ethoxy-2-(4-propan-2-yloxyphenyl)ethanamine (PubChem CID 66072366) has the molecular formula C13H21NO2 and a molecular weight of 223.32 g/mol. Its IUPAC name is 2-ethoxy-2-(4-propan-2-yloxyphenyl)ethanamine.

Molecular Properties

Compound Name2-ethoxy-2-(4-propan-2-yloxyphenyl)ethanamine
PubChem CID66072366
Molecular FormulaC13H21NO2
Molecular Weight223.32 g/mol
Exact Mass223.16
IUPAC Name2-ethoxy-2-(4-propan-2-yloxyphenyl)ethanamine
SMILESCCOC(CN)c1ccc(OC(C)C)cc1
InChIInChI=1S/C13H21NO2/c1-4-15-13(9-14)11-5-7-12(8-6-11)16-10(2)3/h5-8,10,13H,4,9,14H2,1-3H3
InChIKeyIEJFLPLSDIJOJA-UHFFFAOYSA-N
XLogP2.51
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-ethoxy-2-(4-propan-2-ylphenyl)ethanamine
CID 66071740
1-(4-propan-2-yloxyphenyl)-N,N-dipropylethane-1,2-diamine
CID 16642868
(2S)-2-[4-[(1S)-1-ethoxypropyl]phenyl]propan-1-amine
CID 124500502
(2R)-2-[4-[(1S)-1-ethoxypropyl]phenyl]propan-1-amine
CID 124500500
2-ethoxy-2-naphthalen-2-ylethanamine
CID 53276132
2-amino-1-[4-(1-ethoxyethoxy)phenyl]ethanol
CID 11379114
1-butan-2-yl-4-propan-2-yloxybenzene
CID 18730967
(1R)-1-(4-propan-2-yloxyphenyl)butane-1,4-diamine
CID 171210758
2,2-diethoxy-N-[1-(4-propan-2-yloxyphenyl)ethyl]ethanamine
CID 79537975
(1S)-1-(4-propan-2-yloxyphenyl)ethanamine
CID 7446792
[2-ethoxy-1-(4-propan-2-yloxyphenyl)pentyl]hydrazine
CID 105271540
(1S)-1-(4-propan-2-yloxyphenyl)propane-1,3-diamine;hydrochloride
CID 171230356

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-2-(4-propan-2-yloxyphenyl)ethanamine?
The IUPAC name of 2-ethoxy-2-(4-propan-2-yloxyphenyl)ethanamine (CID 66072366) is 2-ethoxy-2-(4-propan-2-yloxyphenyl)ethanamine.
What is the SMILES notation for 2-ethoxy-2-(4-propan-2-yloxyphenyl)ethanamine?
The canonical SMILES for 2-ethoxy-2-(4-propan-2-yloxyphenyl)ethanamine is CCOC(CN)c1ccc(OC(C)C)cc1.
What is the InChIKey of 2-ethoxy-2-(4-propan-2-yloxyphenyl)ethanamine?
The InChIKey is IEJFLPLSDIJOJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NO2/c1-4-15-13(9-14)11-5-7-12(8-6-11)16-10(2)3/h5-8,10,13H,4,9,14H2,1-3H3.
What are the key properties of 2-ethoxy-2-(4-propan-2-yloxyphenyl)ethanamine?
2-ethoxy-2-(4-propan-2-yloxyphenyl)ethanamine has a molecular weight of 223.32 g/mol, XLogP of 2.51, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-2-(4-propan-2-yloxyphenyl)ethanamine is sourced from PubChem (CID 66072366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).