[2-[(4-chloro-2-fluorophenyl)methoxy]-3-fluorophenyl]methanamine

C14H12ClF2NO — CID 114848317

IUPAC[2-[(4-chloro-2-fluorophenyl)methoxy]-3-fluorophenyl]methanamine
SMILESNCc1cccc(F)c1OCc1ccc(Cl)cc1F
InChIInChI=1S/C14H12ClF2NO/c15-11-5-4-10(13(17)6-11)8-19-14-9(7-18)2-1-3-12(14)16/h1-6H,7-8,18H2
InChIKeyIYOLSZINTYLRPE-UHFFFAOYSA-N
MW283.71 g/mol
LogP3.66
Rot. Bonds4

About [2-[(4-chloro-2-fluorophenyl)methoxy]-3-fluorophenyl]methanamine

[2-[(4-chloro-2-fluorophenyl)methoxy]-3-fluorophenyl]methanamine (PubChem CID 114848317) has the molecular formula C14H12ClF2NO and a molecular weight of 283.71 g/mol. Its IUPAC name is [2-[(4-chloro-2-fluorophenyl)methoxy]-3-fluorophenyl]methanamine.

Molecular Properties

Compound Name[2-[(4-chloro-2-fluorophenyl)methoxy]-3-fluorophenyl]methanamine
PubChem CID114848317
Molecular FormulaC14H12ClF2NO
Molecular Weight283.71 g/mol
Exact Mass283.06
IUPAC Name[2-[(4-chloro-2-fluorophenyl)methoxy]-3-fluorophenyl]methanamine
SMILESNCc1cccc(F)c1OCc1ccc(Cl)cc1F
InChIInChI=1S/C14H12ClF2NO/c15-11-5-4-10(13(17)6-11)8-19-14-9(7-18)2-1-3-12(14)16/h1-6H,7-8,18H2
InChIKeyIYOLSZINTYLRPE-UHFFFAOYSA-N
XLogP3.66
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.71
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[2-[(4-chloro-2-fluorophenyl)methoxy]-3-fluorophenyl]propan-2-amine
CID 114857545
4-[[2-(aminomethyl)-6-fluorophenoxy]methyl]-3-fluorobenzonitrile
CID 115952042
[2-[(4-bromo-2-fluorophenyl)methoxy]-3-chlorophenyl]methanamine
CID 112607867
2-[3-bromo-2-[(4-chloro-2-fluorophenyl)methoxy]phenyl]ethanamine
CID 114857497
[4-[(2-chloro-6-fluorophenoxy)methyl]-3-fluorophenyl]methanamine
CID 83050975
[2-chloro-6-[(4-chloro-2-fluorophenyl)methoxy]phenyl]methanamine
CID 114848279
[3-chloro-2-[(2-chloro-6-fluorophenyl)methoxy]phenyl]methanamine
CID 112607809
[2-[(5-chlorothiophen-2-yl)methoxy]-3-fluorophenyl]methanamine
CID 112608155
[2-[(2,4-difluorophenyl)methoxy]-3-methylphenyl]methanamine
CID 112607460
1-(bromomethyl)-2-[(4-chloro-2-fluorophenyl)methoxy]-3-methylbenzene
CID 114850389
2-[2-[(2-chloro-3-fluorophenyl)methoxy]-3-fluorophenyl]ethanamine
CID 115984055
[2-[(2,5-dichlorophenyl)methoxy]-3-fluorophenyl]methanol
CID 112612937

Frequently Asked Questions

What is the IUPAC name of [2-[(4-chloro-2-fluorophenyl)methoxy]-3-fluorophenyl]methanamine?
The IUPAC name of [2-[(4-chloro-2-fluorophenyl)methoxy]-3-fluorophenyl]methanamine (CID 114848317) is [2-[(4-chloro-2-fluorophenyl)methoxy]-3-fluorophenyl]methanamine.
What is the SMILES notation for [2-[(4-chloro-2-fluorophenyl)methoxy]-3-fluorophenyl]methanamine?
The canonical SMILES for [2-[(4-chloro-2-fluorophenyl)methoxy]-3-fluorophenyl]methanamine is NCc1cccc(F)c1OCc1ccc(Cl)cc1F.
What is the InChIKey of [2-[(4-chloro-2-fluorophenyl)methoxy]-3-fluorophenyl]methanamine?
The InChIKey is IYOLSZINTYLRPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12ClF2NO/c15-11-5-4-10(13(17)6-11)8-19-14-9(7-18)2-1-3-12(14)16/h1-6H,7-8,18H2.
What are the key properties of [2-[(4-chloro-2-fluorophenyl)methoxy]-3-fluorophenyl]methanamine?
[2-[(4-chloro-2-fluorophenyl)methoxy]-3-fluorophenyl]methanamine has a molecular weight of 283.71 g/mol, XLogP of 3.66, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(4-chloro-2-fluorophenyl)methoxy]-3-fluorophenyl]methanamine is sourced from PubChem (CID 114848317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).