[5-fluoro-2-(oxolan-3-yloxy)phenyl]methanamine

C11H14FNO2 — CID 63673157

IUPAC[5-fluoro-2-(oxolan-3-yloxy)phenyl]methanamine
SMILESNCc1cc(F)ccc1OC1CCOC1
InChIInChI=1S/C11H14FNO2/c12-9-1-2-11(8(5-9)6-13)15-10-3-4-14-7-10/h1-2,5,10H,3-4,6-7,13H2
InChIKeyXFHMJPOQMJTNJO-UHFFFAOYSA-N
MW211.24 g/mol
LogP1.45
Rot. Bonds3

About [5-fluoro-2-(oxolan-3-yloxy)phenyl]methanamine

[5-fluoro-2-(oxolan-3-yloxy)phenyl]methanamine (PubChem CID 63673157) has the molecular formula C11H14FNO2 and a molecular weight of 211.24 g/mol. Its IUPAC name is [5-fluoro-2-(oxolan-3-yloxy)phenyl]methanamine.

Molecular Properties

Compound Name[5-fluoro-2-(oxolan-3-yloxy)phenyl]methanamine
PubChem CID63673157
Molecular FormulaC11H14FNO2
Molecular Weight211.24 g/mol
Exact Mass211.10
IUPAC Name[5-fluoro-2-(oxolan-3-yloxy)phenyl]methanamine
SMILESNCc1cc(F)ccc1OC1CCOC1
InChIInChI=1S/C11H14FNO2/c12-9-1-2-11(8(5-9)6-13)15-10-3-4-14-7-10/h1-2,5,10H,3-4,6-7,13H2
InChIKeyXFHMJPOQMJTNJO-UHFFFAOYSA-N
XLogP1.45
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.24
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[5-chloro-2-(oxolan-3-yloxy)phenyl]methanamine
CID 63558607
N-[[5-fluoro-2-(oxolan-3-yloxy)phenyl]methyl]ethanamine
CID 107695497
1-[5-fluoro-2-(oxan-3-yloxy)phenyl]-N-methylmethanamine
CID 107695044
(3S)-3-(2-bromo-5-fluorophenoxy)oxolane
CID 118590561
3-(4-fluoro-2-propan-2-ylphenoxy)oxolane
CID 164786398
[5-methyl-2-(oxan-4-yloxy)phenyl]methanamine
CID 63936820
N-[[5-fluoro-2-(oxan-4-yloxy)phenyl]methyl]propan-1-amine
CID 107695883
4-[2-(bromomethyl)-4-fluorophenoxy]-1,9-dioxaspiro[5.5]undecane
CID 107699038
(1R)-1-[4-fluoro-2-(oxolan-3-yloxy)phenyl]ethanol
CID 63557560
2-[5-fluoro-2-[(3R)-oxolan-3-yl]oxyphenyl]-1H-pyrrole
CID 141369902
3-(2-cyclopropyloxy-5-fluorophenyl)propan-1-amine
CID 117298784
4-fluoro-2-(oxolan-3-yloxymethyl)benzonitrile
CID 107903450

Frequently Asked Questions

What is the IUPAC name of [5-fluoro-2-(oxolan-3-yloxy)phenyl]methanamine?
The IUPAC name of [5-fluoro-2-(oxolan-3-yloxy)phenyl]methanamine (CID 63673157) is [5-fluoro-2-(oxolan-3-yloxy)phenyl]methanamine.
What is the SMILES notation for [5-fluoro-2-(oxolan-3-yloxy)phenyl]methanamine?
The canonical SMILES for [5-fluoro-2-(oxolan-3-yloxy)phenyl]methanamine is NCc1cc(F)ccc1OC1CCOC1.
What is the InChIKey of [5-fluoro-2-(oxolan-3-yloxy)phenyl]methanamine?
The InChIKey is XFHMJPOQMJTNJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14FNO2/c12-9-1-2-11(8(5-9)6-13)15-10-3-4-14-7-10/h1-2,5,10H,3-4,6-7,13H2.
What are the key properties of [5-fluoro-2-(oxolan-3-yloxy)phenyl]methanamine?
[5-fluoro-2-(oxolan-3-yloxy)phenyl]methanamine has a molecular weight of 211.24 g/mol, XLogP of 1.45, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [5-fluoro-2-(oxolan-3-yloxy)phenyl]methanamine is sourced from PubChem (CID 63673157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).