[4-(4-fluorophenoxy)phenyl]methanamine;hydrochloride

C13H13ClFNO — CID 10308088

IUPAC[4-(4-fluorophenoxy)phenyl]methanamine;hydrochloride
SMILESCl.NCc1ccc(Oc2ccc(F)cc2)cc1
InChIInChI=1S/C13H12FNO.ClH/c14-11-3-7-13(8-4-11)16-12-5-1-10(9-15)2-6-12;/h1-8H,9,15H2;1H
InChIKeyFSCHAOUFEVMQOV-UHFFFAOYSA-N
MW253.70 g/mol
LogP3.50
Rot. Bonds3

About [4-(4-fluorophenoxy)phenyl]methanamine;hydrochloride

[4-(4-fluorophenoxy)phenyl]methanamine;hydrochloride (PubChem CID 10308088) has the molecular formula C13H13ClFNO and a molecular weight of 253.70 g/mol. Its IUPAC name is [4-(4-fluorophenoxy)phenyl]methanamine;hydrochloride.

Molecular Properties

Compound Name[4-(4-fluorophenoxy)phenyl]methanamine;hydrochloride
PubChem CID10308088
Molecular FormulaC13H13ClFNO
Molecular Weight253.70 g/mol
Exact Mass253.07
IUPAC Name[4-(4-fluorophenoxy)phenyl]methanamine;hydrochloride
SMILESCl.NCc1ccc(Oc2ccc(F)cc2)cc1
InChIInChI=1S/C13H12FNO.ClH/c14-11-3-7-13(8-4-11)16-12-5-1-10(9-15)2-6-12;/h1-8H,9,15H2;1H
InChIKeyFSCHAOUFEVMQOV-UHFFFAOYSA-N
XLogP3.50
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.70
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

ethane;(4-fluorophenyl)methanamine
CID 142071105
[4-[4-(trifluoromethyl)phenoxy]phenyl]methanamine
CID 3809622
2-[4-(4-fluorophenoxy)phenyl]acetaldehyde
CID 87855455
O-(4-fluorophenyl) N-[4-(aminomethyl)phenyl]-N-(4-fluorophenoxy)carbothioylcarbamothioate
CID 86296237
1-fluoro-4-[3-[3-[3-[3-(4-fluorophenoxy)phenoxy]phenoxy]phenoxy]phenoxy]benzene
CID 22338364
4-[4-(aminomethyl)phenoxy]benzenesulfonamide
CID 106485731
[4-(4-propoxyphenoxy)phenyl]methanamine
CID 28971093
methyl 4-[4-(aminomethyl)phenoxy]benzoate;hydrochloride
CID 155817718
tris[4-(aminomethyl)phenyl] borate;hydrochloride
CID 156901124
[4-(4-phenylmethoxyphenoxy)phenyl]methanamine
CID 139985270
[4-(4-methylsulfonylphenoxy)phenyl]methanamine
CID 43806811
[4-(2-chlorophenoxy)phenyl]methanamine
CID 5152206

Frequently Asked Questions

What is the IUPAC name of [4-(4-fluorophenoxy)phenyl]methanamine;hydrochloride?
The IUPAC name of [4-(4-fluorophenoxy)phenyl]methanamine;hydrochloride (CID 10308088) is [4-(4-fluorophenoxy)phenyl]methanamine;hydrochloride.
What is the SMILES notation for [4-(4-fluorophenoxy)phenyl]methanamine;hydrochloride?
The canonical SMILES for [4-(4-fluorophenoxy)phenyl]methanamine;hydrochloride is Cl.NCc1ccc(Oc2ccc(F)cc2)cc1.
What is the InChIKey of [4-(4-fluorophenoxy)phenyl]methanamine;hydrochloride?
The InChIKey is FSCHAOUFEVMQOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12FNO.ClH/c14-11-3-7-13(8-4-11)16-12-5-1-10(9-15)2-6-12;/h1-8H,9,15H2;1H.
What are the key properties of [4-(4-fluorophenoxy)phenyl]methanamine;hydrochloride?
[4-(4-fluorophenoxy)phenyl]methanamine;hydrochloride has a molecular weight of 253.70 g/mol, XLogP of 3.50, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(4-fluorophenoxy)phenyl]methanamine;hydrochloride is sourced from PubChem (CID 10308088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).