2-[(3-chlorophenyl)methoxy]-2-(2-fluorophenyl)-N-methylethanamine

C16H17ClFNO — CID 65124389

IUPAC2-[(3-chlorophenyl)methoxy]-2-(2-fluorophenyl)-N-methylethanamine
SMILESCNCC(OCc1cccc(Cl)c1)c1ccccc1F
InChIInChI=1S/C16H17ClFNO/c1-19-10-16(14-7-2-3-8-15(14)18)20-11-12-5-4-6-13(17)9-12/h2-9,16,19H,10-11H2,1H3
InChIKeyAOMCEGPXHHHHGX-UHFFFAOYSA-N
MW293.77 g/mol
LogP3.96
Rot. Bonds6

About 2-[(3-chlorophenyl)methoxy]-2-(2-fluorophenyl)-N-methylethanamine

2-[(3-chlorophenyl)methoxy]-2-(2-fluorophenyl)-N-methylethanamine (PubChem CID 65124389) has the molecular formula C16H17ClFNO and a molecular weight of 293.77 g/mol. Its IUPAC name is 2-[(3-chlorophenyl)methoxy]-2-(2-fluorophenyl)-N-methylethanamine.

Molecular Properties

Compound Name2-[(3-chlorophenyl)methoxy]-2-(2-fluorophenyl)-N-methylethanamine
PubChem CID65124389
Molecular FormulaC16H17ClFNO
Molecular Weight293.77 g/mol
Exact Mass293.10
IUPAC Name2-[(3-chlorophenyl)methoxy]-2-(2-fluorophenyl)-N-methylethanamine
SMILESCNCC(OCc1cccc(Cl)c1)c1ccccc1F
InChIInChI=1S/C16H17ClFNO/c1-19-10-16(14-7-2-3-8-15(14)18)20-11-12-5-4-6-13(17)9-12/h2-9,16,19H,10-11H2,1H3
InChIKeyAOMCEGPXHHHHGX-UHFFFAOYSA-N
XLogP3.96
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.77
LogP ≤ 53.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(3-chlorophenyl)methoxy]-2-(2-fluorophenyl)ethanamine
CID 65124766
2-[(2-bromophenyl)methoxy]-2-(2-fluorophenyl)-N-methylethanamine
CID 82831669
2-(2-fluorophenyl)-N-methyl-2-propoxyethanamine
CID 62108186
(2R)-2-(2-fluorophenyl)-2-methoxy-N-methylethanamine
CID 94355994
1-[2-bromo-1-[(3-chlorophenyl)methoxy]ethyl]-2-methylbenzene
CID 65124818
2-[(3-methoxyphenyl)methoxy]-N-methyl-2-(2-methylphenyl)ethanamine
CID 62106288
2-(2-fluorophenyl)-N-methyl-2-[(2-methylpropan-2-yl)oxy]ethanamine
CID 62107488
2-[(3-chlorophenyl)methoxy]-N-ethyl-2-(3-fluorophenyl)ethanamine
CID 65124788
2-(2-fluorophenyl)-2-(3-methoxy-3-methylbutoxy)-N-methylethanamine
CID 106667015
2-(2-fluorophenyl)-2-[3-(2-methoxyethoxy)propoxy]-N-methylethanamine
CID 103405175
3-(3-chlorophenyl)-N-[2-(2-fluorophenyl)-2-hydroxyethyl]-2-methylpropanamide
CID 109478347
2-(4-fluorophenyl)-2-[(3-methoxyphenyl)methoxy]-N-methylethanamine
CID 62106822

Frequently Asked Questions

What is the IUPAC name of 2-[(3-chlorophenyl)methoxy]-2-(2-fluorophenyl)-N-methylethanamine?
The IUPAC name of 2-[(3-chlorophenyl)methoxy]-2-(2-fluorophenyl)-N-methylethanamine (CID 65124389) is 2-[(3-chlorophenyl)methoxy]-2-(2-fluorophenyl)-N-methylethanamine.
What is the SMILES notation for 2-[(3-chlorophenyl)methoxy]-2-(2-fluorophenyl)-N-methylethanamine?
The canonical SMILES for 2-[(3-chlorophenyl)methoxy]-2-(2-fluorophenyl)-N-methylethanamine is CNCC(OCc1cccc(Cl)c1)c1ccccc1F.
What is the InChIKey of 2-[(3-chlorophenyl)methoxy]-2-(2-fluorophenyl)-N-methylethanamine?
The InChIKey is AOMCEGPXHHHHGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17ClFNO/c1-19-10-16(14-7-2-3-8-15(14)18)20-11-12-5-4-6-13(17)9-12/h2-9,16,19H,10-11H2,1H3.
What are the key properties of 2-[(3-chlorophenyl)methoxy]-2-(2-fluorophenyl)-N-methylethanamine?
2-[(3-chlorophenyl)methoxy]-2-(2-fluorophenyl)-N-methylethanamine has a molecular weight of 293.77 g/mol, XLogP of 3.96, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-chlorophenyl)methoxy]-2-(2-fluorophenyl)-N-methylethanamine is sourced from PubChem (CID 65124389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).