2-(2-fluorophenyl)-N-methyl-2-(oxolan-3-ylmethoxy)ethanamine

C14H20FNO2 — CID 62110742

IUPAC2-(2-fluorophenyl)-N-methyl-2-(oxolan-3-ylmethoxy)ethanamine
SMILESCNCC(OCC1CCOC1)c1ccccc1F
InChIInChI=1S/C14H20FNO2/c1-16-8-14(12-4-2-3-5-13(12)15)18-10-11-6-7-17-9-11/h2-5,11,14,16H,6-10H2,1H3
InChIKeyGMWSQWDBBOUEHM-UHFFFAOYSA-N
MW253.32 g/mol
LogP2.14
Rot. Bonds6

About 2-(2-fluorophenyl)-N-methyl-2-(oxolan-3-ylmethoxy)ethanamine

2-(2-fluorophenyl)-N-methyl-2-(oxolan-3-ylmethoxy)ethanamine (PubChem CID 62110742) has the molecular formula C14H20FNO2 and a molecular weight of 253.32 g/mol. Its IUPAC name is 2-(2-fluorophenyl)-N-methyl-2-(oxolan-3-ylmethoxy)ethanamine.

Molecular Properties

Compound Name2-(2-fluorophenyl)-N-methyl-2-(oxolan-3-ylmethoxy)ethanamine
PubChem CID62110742
Molecular FormulaC14H20FNO2
Molecular Weight253.32 g/mol
Exact Mass253.15
IUPAC Name2-(2-fluorophenyl)-N-methyl-2-(oxolan-3-ylmethoxy)ethanamine
SMILESCNCC(OCC1CCOC1)c1ccccc1F
InChIInChI=1S/C14H20FNO2/c1-16-8-14(12-4-2-3-5-13(12)15)18-10-11-6-7-17-9-11/h2-5,11,14,16H,6-10H2,1H3
InChIKeyGMWSQWDBBOUEHM-UHFFFAOYSA-N
XLogP2.14
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.32
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-2-(3-methylphenyl)-2-(oxolan-3-ylmethoxy)ethanamine
CID 62111410
N-ethyl-2-(2-methoxyphenyl)-2-(oxolan-3-ylmethoxy)ethanamine
CID 62111411
N-[2-(2-chlorophenyl)-2-(oxolan-3-ylmethoxy)ethyl]-2-methylpropan-2-amine
CID 62110739
(2R)-2-(2-fluorophenyl)-2-methoxy-N-methylethanamine
CID 94355994
2-(2-fluorophenyl)-N-methyl-2-propoxyethanamine
CID 62108186
3-[[1-(2-bromophenyl)-2-iodoethoxy]methyl]oxolane
CID 114773806
1-(2-fluorophenyl)-2-(oxolan-3-yl)ethanol
CID 103986373
3-[(2-fluorophenoxy)methyl]oxolane
CID 60773526
2-(2-fluorophenyl)-N-methyl-2-[(2-methylpropan-2-yl)oxy]ethanamine
CID 62107488
2-fluoro-N-[2-(oxolan-3-ylmethoxy)ethyl]aniline
CID 62585173
2-bromo-N-[2-(cyclopropylmethoxy)-2-(2-fluorophenyl)ethyl]acetamide
CID 102548633
(2S)-2-bromo-N-[(2R)-2-(cyclopropylmethoxy)-2-(2-fluorophenyl)ethyl]propanamide
CID 97181643

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenyl)-N-methyl-2-(oxolan-3-ylmethoxy)ethanamine?
The IUPAC name of 2-(2-fluorophenyl)-N-methyl-2-(oxolan-3-ylmethoxy)ethanamine (CID 62110742) is 2-(2-fluorophenyl)-N-methyl-2-(oxolan-3-ylmethoxy)ethanamine.
What is the SMILES notation for 2-(2-fluorophenyl)-N-methyl-2-(oxolan-3-ylmethoxy)ethanamine?
The canonical SMILES for 2-(2-fluorophenyl)-N-methyl-2-(oxolan-3-ylmethoxy)ethanamine is CNCC(OCC1CCOC1)c1ccccc1F.
What is the InChIKey of 2-(2-fluorophenyl)-N-methyl-2-(oxolan-3-ylmethoxy)ethanamine?
The InChIKey is GMWSQWDBBOUEHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FNO2/c1-16-8-14(12-4-2-3-5-13(12)15)18-10-11-6-7-17-9-11/h2-5,11,14,16H,6-10H2,1H3.
What are the key properties of 2-(2-fluorophenyl)-N-methyl-2-(oxolan-3-ylmethoxy)ethanamine?
2-(2-fluorophenyl)-N-methyl-2-(oxolan-3-ylmethoxy)ethanamine has a molecular weight of 253.32 g/mol, XLogP of 2.14, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenyl)-N-methyl-2-(oxolan-3-ylmethoxy)ethanamine is sourced from PubChem (CID 62110742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).