2-(3-fluorophenyl)-2-methyloxolan-3-amine

C11H14FNO — CID 105449016

IUPAC2-(3-fluorophenyl)-2-methyloxolan-3-amine
SMILESCC1(c2cccc(F)c2)OCCC1N
InChIInChI=1S/C11H14FNO/c1-11(10(13)5-6-14-11)8-3-2-4-9(12)7-8/h2-4,7,10H,5-6,13H2,1H3
InChIKeyJUHDRSSBHGXXPU-UHFFFAOYSA-N
MW195.24 g/mol
LogP1.79
Rot. Bonds1

About 2-(3-fluorophenyl)-2-methyloxolan-3-amine

2-(3-fluorophenyl)-2-methyloxolan-3-amine (PubChem CID 105449016) has the molecular formula C11H14FNO and a molecular weight of 195.24 g/mol. Its IUPAC name is 2-(3-fluorophenyl)-2-methyloxolan-3-amine.

Molecular Properties

Compound Name2-(3-fluorophenyl)-2-methyloxolan-3-amine
PubChem CID105449016
Molecular FormulaC11H14FNO
Molecular Weight195.24 g/mol
Exact Mass195.11
IUPAC Name2-(3-fluorophenyl)-2-methyloxolan-3-amine
SMILESCC1(c2cccc(F)c2)OCCC1N
InChIInChI=1S/C11H14FNO/c1-11(10(13)5-6-14-11)8-3-2-4-9(12)7-8/h2-4,7,10H,5-6,13H2,1H3
InChIKeyJUHDRSSBHGXXPU-UHFFFAOYSA-N
XLogP1.79
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.24
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-fluorophenyl)-2-methyloxolane-3-carboxylic acid
CID 105481638
2-(3-fluorophenyl)-2-methylcyclopropan-1-amine
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(1R)-2-(3-fluorophenyl)-2-methylcyclopropan-1-amine
CID 105432735
2-(3-fluorophenyl)-2-methylcyclobutan-1-ol
CID 130118878
2-(3-fluorophenyl)-1,1,3,3-tetramethyl-5,8-dioxaspiro[3.4]octan-2-ol
CID 15905279
1-fluoro-3-(1-methylcyclopropyl)benzene
CID 90779989
4-chloro-2-ethyl-2-(3-fluorophenyl)oxane
CID 114872983
(4-amino-3,3-dimethylpiperidin-1-yl)-[4-(3-fluorophenyl)oxan-4-yl]methanone;hydrochloride
CID 120818399
2-(3-fluorophenyl)-2-methyl-1,3-oxazolidine;hydrochloride
CID 117227522
2-(3-fluorophenyl)-2,4-dimethyl-1,3-oxazolidine
CID 117228450
4-(3-amino-2-methyloxan-2-yl)phenol
CID 15643838
[2-(3-fluorophenyl)-2-methylcyclopropyl]methanol
CID 81358099

Frequently Asked Questions

What is the IUPAC name of 2-(3-fluorophenyl)-2-methyloxolan-3-amine?
The IUPAC name of 2-(3-fluorophenyl)-2-methyloxolan-3-amine (CID 105449016) is 2-(3-fluorophenyl)-2-methyloxolan-3-amine.
What is the SMILES notation for 2-(3-fluorophenyl)-2-methyloxolan-3-amine?
The canonical SMILES for 2-(3-fluorophenyl)-2-methyloxolan-3-amine is CC1(c2cccc(F)c2)OCCC1N.
What is the InChIKey of 2-(3-fluorophenyl)-2-methyloxolan-3-amine?
The InChIKey is JUHDRSSBHGXXPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14FNO/c1-11(10(13)5-6-14-11)8-3-2-4-9(12)7-8/h2-4,7,10H,5-6,13H2,1H3.
What are the key properties of 2-(3-fluorophenyl)-2-methyloxolan-3-amine?
2-(3-fluorophenyl)-2-methyloxolan-3-amine has a molecular weight of 195.24 g/mol, XLogP of 1.79, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluorophenyl)-2-methyloxolan-3-amine is sourced from PubChem (CID 105449016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).