[2-(2-chloro-5-fluorophenyl)phenyl]methanamine

C13H11ClFN — CID 105395671

IUPAC[2-(2-chloro-5-fluorophenyl)phenyl]methanamine
SMILESNCc1ccccc1-c1cc(F)ccc1Cl
InChIInChI=1S/C13H11ClFN/c14-13-6-5-10(15)7-12(13)11-4-2-1-3-9(11)8-16/h1-7H,8,16H2
InChIKeyDTSAPFSCXGHICO-UHFFFAOYSA-N
MW235.69 g/mol
LogP3.60
Rot. Bonds2

About [2-(2-chloro-5-fluorophenyl)phenyl]methanamine

[2-(2-chloro-5-fluorophenyl)phenyl]methanamine (PubChem CID 105395671) has the molecular formula C13H11ClFN and a molecular weight of 235.69 g/mol. Its IUPAC name is [2-(2-chloro-5-fluorophenyl)phenyl]methanamine.

Molecular Properties

Compound Name[2-(2-chloro-5-fluorophenyl)phenyl]methanamine
PubChem CID105395671
Molecular FormulaC13H11ClFN
Molecular Weight235.69 g/mol
Exact Mass235.06
IUPAC Name[2-(2-chloro-5-fluorophenyl)phenyl]methanamine
SMILESNCc1ccccc1-c1cc(F)ccc1Cl
InChIInChI=1S/C13H11ClFN/c14-13-6-5-10(15)7-12(13)11-4-2-1-3-9(11)8-16/h1-7H,8,16H2
InChIKeyDTSAPFSCXGHICO-UHFFFAOYSA-N
XLogP3.60
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.69
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

[2-(2,5-dichlorophenyl)-5-fluorophenyl]methanamine
CID 104729171
[2-(2-chloro-5-fluorophenyl)-4-ethoxyphenyl]methanamine
CID 172653787
(4-fluoro-2-phenylphenyl)methanamine
CID 46314898
[2-(2-chloro-5-fluorophenyl)-4-propan-2-yloxyphenyl]methanamine;hydrochloride
CID 172653793
[2-[2-(aminomethyl)-4-chlorophenyl]phenyl]methanamine
CID 143648199
2-(aminomethyl)-N-(2-chloro-5-fluorophenyl)benzenesulfonamide
CID 106088506
[2-(2-chloro-5-fluorophenyl)-4-fluorophenyl]methanol
CID 172653766
[2-(4-chloro-2,5-dimethylphenyl)-4-fluorophenyl]methanamine
CID 114060514
[5-fluoro-2-(2,3,4,5,6-pentachlorophenyl)phenyl]methanamine
CID 134631525
[5-(2-chlorophenyl)-2-fluorophenyl]methanamine
CID 61029562
[3-(2-chloro-5-fluorophenyl)-4-phenylmethoxyphenyl]methanamine
CID 172653869
1-chloro-4-fluoro-2-(2-nitrophenyl)benzene
CID 142744710

Frequently Asked Questions

What is the IUPAC name of [2-(2-chloro-5-fluorophenyl)phenyl]methanamine?
The IUPAC name of [2-(2-chloro-5-fluorophenyl)phenyl]methanamine (CID 105395671) is [2-(2-chloro-5-fluorophenyl)phenyl]methanamine.
What is the SMILES notation for [2-(2-chloro-5-fluorophenyl)phenyl]methanamine?
The canonical SMILES for [2-(2-chloro-5-fluorophenyl)phenyl]methanamine is NCc1ccccc1-c1cc(F)ccc1Cl.
What is the InChIKey of [2-(2-chloro-5-fluorophenyl)phenyl]methanamine?
The InChIKey is DTSAPFSCXGHICO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11ClFN/c14-13-6-5-10(15)7-12(13)11-4-2-1-3-9(11)8-16/h1-7H,8,16H2.
What are the key properties of [2-(2-chloro-5-fluorophenyl)phenyl]methanamine?
[2-(2-chloro-5-fluorophenyl)phenyl]methanamine has a molecular weight of 235.69 g/mol, XLogP of 3.60, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-chloro-5-fluorophenyl)phenyl]methanamine is sourced from PubChem (CID 105395671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).