N-(4-fluorophenyl)oxan-4-amine

C11H14FNO — CID 25219450

IUPACN-(4-fluorophenyl)oxan-4-amine
SMILESFc1ccc(NC2CCOCC2)cc1
InChIInChI=1S/C11H14FNO/c12-9-1-3-10(4-2-9)13-11-5-7-14-8-6-11/h1-4,11,13H,5-8H2
InChIKeySPKGJBMEUWFXJD-UHFFFAOYSA-N
MW195.24 g/mol
LogP2.42
Rot. Bonds2

About N-(4-fluorophenyl)oxan-4-amine

N-(4-fluorophenyl)oxan-4-amine (PubChem CID 25219450) has the molecular formula C11H14FNO and a molecular weight of 195.24 g/mol. Its IUPAC name is N-(4-fluorophenyl)oxan-4-amine.

Molecular Properties

Compound NameN-(4-fluorophenyl)oxan-4-amine
PubChem CID25219450
Molecular FormulaC11H14FNO
Molecular Weight195.24 g/mol
Exact Mass195.11
IUPAC NameN-(4-fluorophenyl)oxan-4-amine
SMILESFc1ccc(NC2CCOCC2)cc1
InChIInChI=1S/C11H14FNO/c12-9-1-3-10(4-2-9)13-11-5-7-14-8-6-11/h1-4,11,13H,5-8H2
InChIKeySPKGJBMEUWFXJD-UHFFFAOYSA-N
XLogP2.42
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.24
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)oxan-4-amine?
The IUPAC name of N-(4-fluorophenyl)oxan-4-amine (CID 25219450) is N-(4-fluorophenyl)oxan-4-amine.
What is the SMILES notation for N-(4-fluorophenyl)oxan-4-amine?
The canonical SMILES for N-(4-fluorophenyl)oxan-4-amine is Fc1ccc(NC2CCOCC2)cc1.
What is the InChIKey of N-(4-fluorophenyl)oxan-4-amine?
The InChIKey is SPKGJBMEUWFXJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14FNO/c12-9-1-3-10(4-2-9)13-11-5-7-14-8-6-11/h1-4,11,13H,5-8H2.
What are the key properties of N-(4-fluorophenyl)oxan-4-amine?
N-(4-fluorophenyl)oxan-4-amine has a molecular weight of 195.24 g/mol, XLogP of 2.42, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)oxan-4-amine is sourced from PubChem (CID 25219450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).