2-fluoro-4-piperidin-3-yloxyaniline

C11H15FN2O — CID 89089134

IUPAC2-fluoro-4-piperidin-3-yloxyaniline
SMILESNc1ccc(OC2CCCNC2)cc1F
InChIInChI=1S/C11H15FN2O/c12-10-6-8(3-4-11(10)13)15-9-2-1-5-14-7-9/h3-4,6,9,14H,1-2,5,7,13H2
InChIKeyRZDWXFCHADLXDE-UHFFFAOYSA-N
MW210.25 g/mol
LogP1.54
Rot. Bonds2

About 2-fluoro-4-piperidin-3-yloxyaniline

2-fluoro-4-piperidin-3-yloxyaniline (PubChem CID 89089134) has the molecular formula C11H15FN2O and a molecular weight of 210.25 g/mol. Its IUPAC name is 2-fluoro-4-piperidin-3-yloxyaniline.

Molecular Properties

Compound Name2-fluoro-4-piperidin-3-yloxyaniline
PubChem CID89089134
Molecular FormulaC11H15FN2O
Molecular Weight210.25 g/mol
Exact Mass210.12
IUPAC Name2-fluoro-4-piperidin-3-yloxyaniline
SMILESNc1ccc(OC2CCCNC2)cc1F
InChIInChI=1S/C11H15FN2O/c12-10-6-8(3-4-11(10)13)15-9-2-1-5-14-7-9/h3-4,6,9,14H,1-2,5,7,13H2
InChIKeyRZDWXFCHADLXDE-UHFFFAOYSA-N
XLogP1.54
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.25
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-fluoro-4-[(3R)-piperidin-3-yl]oxybenzonitrile
CID 86333460
2-fluoro-4-(piperidin-3-ylmethoxy)aniline;dihydrochloride
CID 164576780
(3R)-3-(3,5-difluorophenoxy)piperidine
CID 94586724
3-(2-fluoro-4-methoxyphenoxy)piperidine
CID 84689805
(3R)-3-(3,4-dimethylphenoxy)piperidine
CID 26191417
4-(3,4-difluorophenoxy)azepane
CID 63904830
2-(4-piperidin-3-yloxyphenyl)ethanamine
CID 165357730
2-fluoro-4-(1-methylpiperidin-3-yl)oxyaniline
CID 89223990
(3R)-3-phenoxypiperidine
CID 42553363
(3S)-3-(3-bromo-4-fluorophenoxy)pyrrolidine
CID 83234121
2-fluoro-4-pyrrolidin-3-yloxybenzonitrile
CID 107923350
2-fluoro-4-[(3S)-pyrrolidin-3-yl]oxybenzonitrile
CID 107923342

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-4-piperidin-3-yloxyaniline?
The IUPAC name of 2-fluoro-4-piperidin-3-yloxyaniline (CID 89089134) is 2-fluoro-4-piperidin-3-yloxyaniline.
What is the SMILES notation for 2-fluoro-4-piperidin-3-yloxyaniline?
The canonical SMILES for 2-fluoro-4-piperidin-3-yloxyaniline is Nc1ccc(OC2CCCNC2)cc1F.
What is the InChIKey of 2-fluoro-4-piperidin-3-yloxyaniline?
The InChIKey is RZDWXFCHADLXDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15FN2O/c12-10-6-8(3-4-11(10)13)15-9-2-1-5-14-7-9/h3-4,6,9,14H,1-2,5,7,13H2.
What are the key properties of 2-fluoro-4-piperidin-3-yloxyaniline?
2-fluoro-4-piperidin-3-yloxyaniline has a molecular weight of 210.25 g/mol, XLogP of 1.54, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-4-piperidin-3-yloxyaniline is sourced from PubChem (CID 89089134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).