N-ethyl-1-(2-methoxyphenyl)-3-(oxolan-2-yl)propan-1-amine

C16H25NO2 — CID 65166709

IUPACN-ethyl-1-(2-methoxyphenyl)-3-(oxolan-2-yl)propan-1-amine
SMILESCCNC(CCC1CCCO1)c1ccccc1OC
InChIInChI=1S/C16H25NO2/c1-3-17-15(11-10-13-7-6-12-19-13)14-8-4-5-9-16(14)18-2/h4-5,8-9,13,15,17H,3,6-7,10-12H2,1-2H3
InChIKeyTYZADOMNXNTGPC-UHFFFAOYSA-N
MW263.38 g/mol
LogP3.31
Rot. Bonds7

About N-ethyl-1-(2-methoxyphenyl)-3-(oxolan-2-yl)propan-1-amine

N-ethyl-1-(2-methoxyphenyl)-3-(oxolan-2-yl)propan-1-amine (PubChem CID 65166709) has the molecular formula C16H25NO2 and a molecular weight of 263.38 g/mol. Its IUPAC name is N-ethyl-1-(2-methoxyphenyl)-3-(oxolan-2-yl)propan-1-amine.

Molecular Properties

Compound NameN-ethyl-1-(2-methoxyphenyl)-3-(oxolan-2-yl)propan-1-amine
PubChem CID65166709
Molecular FormulaC16H25NO2
Molecular Weight263.38 g/mol
Exact Mass263.19
IUPAC NameN-ethyl-1-(2-methoxyphenyl)-3-(oxolan-2-yl)propan-1-amine
SMILESCCNC(CCC1CCCO1)c1ccccc1OC
InChIInChI=1S/C16H25NO2/c1-3-17-15(11-10-13-7-6-12-19-13)14-8-4-5-9-16(14)18-2/h4-5,8-9,13,15,17H,3,6-7,10-12H2,1-2H3
InChIKeyTYZADOMNXNTGPC-UHFFFAOYSA-N
XLogP3.31
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-1-(2-methoxy-5-methylphenyl)-4-(oxolan-2-yl)butan-1-amine
CID 104993214
N-ethyl-1-(2-fluorophenyl)-3-(oxan-2-yl)propan-1-amine
CID 115827795
N-ethyl-1-(3-methoxyphenyl)-3-(oxolan-2-yl)propan-1-amine
CID 65166969
1-(2-bromo-3-methylphenyl)-N-ethyl-3-(oxolan-2-yl)propan-1-amine
CID 107985085
N-ethyl-2-(oxolan-2-yl)-1-(2-propoxyphenyl)ethanamine
CID 104659878
N-ethyl-1-(5-fluoro-2-methylphenyl)-3-(oxolan-2-yl)propan-1-amine
CID 65164298
1-(5-chloro-2-methoxyphenyl)-3-(oxolan-2-yl)-N-propylpropan-1-amine
CID 104546060
[1-(2-methoxyphenyl)-2-(oxan-2-yl)ethyl]hydrazine
CID 105267281
1-[2-(difluoromethoxy)phenyl]-N-methyl-3-(oxolan-2-yl)propan-1-amine
CID 104993696
1-(4-chlorophenyl)-N-ethyl-3-(oxolan-2-yl)propan-1-amine
CID 65156023
N-ethyl-3-(oxolan-2-yl)-1-quinolin-2-ylpropan-1-amine
CID 65164311
N-ethyl-1-(2-methoxyphenyl)-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethanamine
CID 66392876

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(2-methoxyphenyl)-3-(oxolan-2-yl)propan-1-amine?
The IUPAC name of N-ethyl-1-(2-methoxyphenyl)-3-(oxolan-2-yl)propan-1-amine (CID 65166709) is N-ethyl-1-(2-methoxyphenyl)-3-(oxolan-2-yl)propan-1-amine.
What is the SMILES notation for N-ethyl-1-(2-methoxyphenyl)-3-(oxolan-2-yl)propan-1-amine?
The canonical SMILES for N-ethyl-1-(2-methoxyphenyl)-3-(oxolan-2-yl)propan-1-amine is CCNC(CCC1CCCO1)c1ccccc1OC.
What is the InChIKey of N-ethyl-1-(2-methoxyphenyl)-3-(oxolan-2-yl)propan-1-amine?
The InChIKey is TYZADOMNXNTGPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO2/c1-3-17-15(11-10-13-7-6-12-19-13)14-8-4-5-9-16(14)18-2/h4-5,8-9,13,15,17H,3,6-7,10-12H2,1-2H3.
What are the key properties of N-ethyl-1-(2-methoxyphenyl)-3-(oxolan-2-yl)propan-1-amine?
N-ethyl-1-(2-methoxyphenyl)-3-(oxolan-2-yl)propan-1-amine has a molecular weight of 263.38 g/mol, XLogP of 3.31, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(2-methoxyphenyl)-3-(oxolan-2-yl)propan-1-amine is sourced from PubChem (CID 65166709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).