N-methyl-2-(oxan-4-yloxy)-2-phenylethanamine

C14H21NO2 — CID 62107330

IUPACN-methyl-2-(oxan-4-yloxy)-2-phenylethanamine
SMILESCNCC(OC1CCOCC1)c1ccccc1
InChIInChI=1S/C14H21NO2/c1-15-11-14(12-5-3-2-4-6-12)17-13-7-9-16-10-8-13/h2-6,13-15H,7-11H2,1H3
InChIKeyVCTLGPIHMRJJOH-UHFFFAOYSA-N
MW235.33 g/mol
LogP2.14
Rot. Bonds5

About N-methyl-2-(oxan-4-yloxy)-2-phenylethanamine

N-methyl-2-(oxan-4-yloxy)-2-phenylethanamine (PubChem CID 62107330) has the molecular formula C14H21NO2 and a molecular weight of 235.33 g/mol. Its IUPAC name is N-methyl-2-(oxan-4-yloxy)-2-phenylethanamine.

Molecular Properties

Compound NameN-methyl-2-(oxan-4-yloxy)-2-phenylethanamine
PubChem CID62107330
Molecular FormulaC14H21NO2
Molecular Weight235.33 g/mol
Exact Mass235.16
IUPAC NameN-methyl-2-(oxan-4-yloxy)-2-phenylethanamine
SMILESCNCC(OC1CCOCC1)c1ccccc1
InChIInChI=1S/C14H21NO2/c1-15-11-14(12-5-3-2-4-6-12)17-13-7-9-16-10-8-13/h2-6,13-15H,7-11H2,1H3
InChIKeyVCTLGPIHMRJJOH-UHFFFAOYSA-N
XLogP2.14
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-2-(oxan-4-yloxy)propan-1-amine
CID 62440891
N-[2-(oxan-4-yloxy)propyl]aniline
CID 62584422
N-methyl-2-(4-methylcyclohexyl)oxy-2-(4-methylphenyl)ethanamine
CID 62108098
N-[2-(4-fluorophenyl)-2-(oxan-4-yloxy)ethyl]propan-1-amine
CID 62107691
2-cyclobutyloxy-2-(3-fluorophenyl)-N-methylethanamine
CID 62383123
1-(oxan-4-yloxy)-1-phenylpropan-2-amine
CID 55017189
2-(4-bromophenyl)-N-methyl-2-(4-methylcyclohexyl)oxyethanamine
CID 55036283
2-cycloheptyloxy-2-(3-fluorophenyl)-N-methylethanamine
CID 62109055
N-[2-(2-bromophenyl)-2-(oxan-4-yloxy)ethyl]propan-2-amine
CID 62108052
2-(methylamino)-1-[3-(oxan-4-yloxy)phenyl]ethanol
CID 115005110
2-(2-bromophenyl)-2-cycloheptyloxy-N-methylethanamine
CID 62109896
N-methyl-2-(2-methylphenyl)-2-(oxetan-3-yloxy)ethanamine
CID 102607797

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(oxan-4-yloxy)-2-phenylethanamine?
The IUPAC name of N-methyl-2-(oxan-4-yloxy)-2-phenylethanamine (CID 62107330) is N-methyl-2-(oxan-4-yloxy)-2-phenylethanamine.
What is the SMILES notation for N-methyl-2-(oxan-4-yloxy)-2-phenylethanamine?
The canonical SMILES for N-methyl-2-(oxan-4-yloxy)-2-phenylethanamine is CNCC(OC1CCOCC1)c1ccccc1.
What is the InChIKey of N-methyl-2-(oxan-4-yloxy)-2-phenylethanamine?
The InChIKey is VCTLGPIHMRJJOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO2/c1-15-11-14(12-5-3-2-4-6-12)17-13-7-9-16-10-8-13/h2-6,13-15H,7-11H2,1H3.
What are the key properties of N-methyl-2-(oxan-4-yloxy)-2-phenylethanamine?
N-methyl-2-(oxan-4-yloxy)-2-phenylethanamine has a molecular weight of 235.33 g/mol, XLogP of 2.14, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(oxan-4-yloxy)-2-phenylethanamine is sourced from PubChem (CID 62107330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).