2-[3-[(2-fluorophenyl)methoxy]phenyl]propan-2-amine

C16H18FNO — CID 146264019

IUPAC2-[3-[(2-fluorophenyl)methoxy]phenyl]propan-2-amine
SMILESCC(C)(N)c1cccc(OCc2ccccc2F)c1
InChIInChI=1S/C16H18FNO/c1-16(2,18)13-7-5-8-14(10-13)19-11-12-6-3-4-9-15(12)17/h3-10H,11,18H2,1-2H3
InChIKeyXUUYQAWDFZUJFE-UHFFFAOYSA-N
MW259.32 g/mol
LogP3.60
Rot. Bonds4

About 2-[3-[(2-fluorophenyl)methoxy]phenyl]propan-2-amine

2-[3-[(2-fluorophenyl)methoxy]phenyl]propan-2-amine (PubChem CID 146264019) has the molecular formula C16H18FNO and a molecular weight of 259.32 g/mol. Its IUPAC name is 2-[3-[(2-fluorophenyl)methoxy]phenyl]propan-2-amine.

Molecular Properties

Compound Name2-[3-[(2-fluorophenyl)methoxy]phenyl]propan-2-amine
PubChem CID146264019
Molecular FormulaC16H18FNO
Molecular Weight259.32 g/mol
Exact Mass259.14
IUPAC Name2-[3-[(2-fluorophenyl)methoxy]phenyl]propan-2-amine
SMILESCC(C)(N)c1cccc(OCc2ccccc2F)c1
InChIInChI=1S/C16H18FNO/c1-16(2,18)13-7-5-8-14(10-13)19-11-12-6-3-4-9-15(12)17/h3-10H,11,18H2,1-2H3
InChIKeyXUUYQAWDFZUJFE-UHFFFAOYSA-N
XLogP3.60
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.32
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[2-[(3-tert-butylphenoxy)methyl]phenyl]methanamine
CID 43169662
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2-[[3-(trifluoromethyl)phenoxy]methyl]phenol
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[3-[(2-fluorophenyl)methoxy]phenyl] carbamate
CID 175148405
(1R)-1-[3-[(2-fluorophenyl)methoxy]phenyl]ethanol
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4-bromo-2-fluoro-1-[[3-(trifluoromethyl)phenoxy]methyl]benzene
CID 60628071
3-[(2-fluorophenyl)methoxy]-N-methylbenzamide
CID 13176420
3-[(2,3-difluorophenyl)methoxy]phenol
CID 43659030
3-[(2-fluorophenyl)methoxy]-5-methylaniline
CID 112648486
N-[[3-[(2-fluorophenyl)methoxy]phenyl]methyl]-1-phenylmethanamine;hydrochloride
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3-[[2-fluoro-5-(trifluoromethyl)phenyl]methoxy]aniline
CID 69123824

Frequently Asked Questions

What is the IUPAC name of 2-[3-[(2-fluorophenyl)methoxy]phenyl]propan-2-amine?
The IUPAC name of 2-[3-[(2-fluorophenyl)methoxy]phenyl]propan-2-amine (CID 146264019) is 2-[3-[(2-fluorophenyl)methoxy]phenyl]propan-2-amine.
What is the SMILES notation for 2-[3-[(2-fluorophenyl)methoxy]phenyl]propan-2-amine?
The canonical SMILES for 2-[3-[(2-fluorophenyl)methoxy]phenyl]propan-2-amine is CC(C)(N)c1cccc(OCc2ccccc2F)c1.
What is the InChIKey of 2-[3-[(2-fluorophenyl)methoxy]phenyl]propan-2-amine?
The InChIKey is XUUYQAWDFZUJFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18FNO/c1-16(2,18)13-7-5-8-14(10-13)19-11-12-6-3-4-9-15(12)17/h3-10H,11,18H2,1-2H3.
What are the key properties of 2-[3-[(2-fluorophenyl)methoxy]phenyl]propan-2-amine?
2-[3-[(2-fluorophenyl)methoxy]phenyl]propan-2-amine has a molecular weight of 259.32 g/mol, XLogP of 3.60, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[(2-fluorophenyl)methoxy]phenyl]propan-2-amine is sourced from PubChem (CID 146264019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).