N-methyl-2-(oxetan-3-yloxy)-1-(4-propylphenyl)ethanamine

C15H23NO2 — CID 102605871

IUPACN-methyl-2-(oxetan-3-yloxy)-1-(4-propylphenyl)ethanamine
SMILESCCCc1ccc(C(COC2COC2)NC)cc1
InChIInChI=1S/C15H23NO2/c1-3-4-12-5-7-13(8-6-12)15(16-2)11-18-14-9-17-10-14/h5-8,14-16H,3-4,9-11H2,1-2H3
InChIKeyGDRHOKOYLVNRKO-UHFFFAOYSA-N
MW249.35 g/mol
LogP2.32
Rot. Bonds7

About N-methyl-2-(oxetan-3-yloxy)-1-(4-propylphenyl)ethanamine

N-methyl-2-(oxetan-3-yloxy)-1-(4-propylphenyl)ethanamine (PubChem CID 102605871) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is N-methyl-2-(oxetan-3-yloxy)-1-(4-propylphenyl)ethanamine.

Molecular Properties

Compound NameN-methyl-2-(oxetan-3-yloxy)-1-(4-propylphenyl)ethanamine
PubChem CID102605871
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC NameN-methyl-2-(oxetan-3-yloxy)-1-(4-propylphenyl)ethanamine
SMILESCCCc1ccc(C(COC2COC2)NC)cc1
InChIInChI=1S/C15H23NO2/c1-3-4-12-5-7-13(8-6-12)15(16-2)11-18-14-9-17-10-14/h5-8,14-16H,3-4,9-11H2,1-2H3
InChIKeyGDRHOKOYLVNRKO-UHFFFAOYSA-N
XLogP2.32
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-1-[4-(2-methylpropyl)phenyl]-2-(oxetan-3-yloxy)ethanamine
CID 102606147
N-methyl-2-(oxan-4-ylmethoxy)-1-(4-propylphenyl)ethanamine
CID 62382237
2-cyclobutyloxy-N-ethyl-1-(4-propylphenyl)ethanamine
CID 62116839
2-cyclobutyloxy-1-(4-ethylphenyl)-N-methylethanamine
CID 62139676
1-(4-ethoxyphenyl)-N-ethyl-2-(oxetan-3-yloxy)ethanamine
CID 102606061
N-[2-cyclopentyloxy-1-(4-propylphenyl)ethyl]propan-1-amine
CID 63473597
2-(4,4-dimethylcyclohexyl)oxy-1-(4-ethylphenyl)-N-methylethanamine
CID 114340831
2-(methylamino)-2-(4-propylphenyl)ethanethiol
CID 116830608
2-(3,4-dimethylcyclohexyl)oxy-1-(4-ethylphenyl)-N-methylethanamine
CID 64745929
2-cyclopentyl-N-methyl-1-(4-propylphenyl)ethanamine
CID 60771358
N,N'-dimethyl-N'-(oxolan-3-yl)-1-(4-propylphenyl)ethane-1,2-diamine
CID 82735589
N,3,3-trimethyl-1-(4-propylphenyl)butan-1-amine
CID 43484923

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(oxetan-3-yloxy)-1-(4-propylphenyl)ethanamine?
The IUPAC name of N-methyl-2-(oxetan-3-yloxy)-1-(4-propylphenyl)ethanamine (CID 102605871) is N-methyl-2-(oxetan-3-yloxy)-1-(4-propylphenyl)ethanamine.
What is the SMILES notation for N-methyl-2-(oxetan-3-yloxy)-1-(4-propylphenyl)ethanamine?
The canonical SMILES for N-methyl-2-(oxetan-3-yloxy)-1-(4-propylphenyl)ethanamine is CCCc1ccc(C(COC2COC2)NC)cc1.
What is the InChIKey of N-methyl-2-(oxetan-3-yloxy)-1-(4-propylphenyl)ethanamine?
The InChIKey is GDRHOKOYLVNRKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2/c1-3-4-12-5-7-13(8-6-12)15(16-2)11-18-14-9-17-10-14/h5-8,14-16H,3-4,9-11H2,1-2H3.
What are the key properties of N-methyl-2-(oxetan-3-yloxy)-1-(4-propylphenyl)ethanamine?
N-methyl-2-(oxetan-3-yloxy)-1-(4-propylphenyl)ethanamine has a molecular weight of 249.35 g/mol, XLogP of 2.32, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(oxetan-3-yloxy)-1-(4-propylphenyl)ethanamine is sourced from PubChem (CID 102605871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).