[4-fluoro-2-(5-fluoro-2-methylphenyl)phenyl]methanamine

C14H13F2N — CID 114060188

IUPAC[4-fluoro-2-(5-fluoro-2-methylphenyl)phenyl]methanamine
SMILESCc1ccc(F)cc1-c1cc(F)ccc1CN
InChIInChI=1S/C14H13F2N/c1-9-2-4-11(15)6-13(9)14-7-12(16)5-3-10(14)8-17/h2-7H,8,17H2,1H3
InChIKeySNCFUUHURLQNCC-UHFFFAOYSA-N
MW233.26 g/mol
LogP3.40
Rot. Bonds2

About [4-fluoro-2-(5-fluoro-2-methylphenyl)phenyl]methanamine

[4-fluoro-2-(5-fluoro-2-methylphenyl)phenyl]methanamine (PubChem CID 114060188) has the molecular formula C14H13F2N and a molecular weight of 233.26 g/mol. Its IUPAC name is [4-fluoro-2-(5-fluoro-2-methylphenyl)phenyl]methanamine.

Molecular Properties

Compound Name[4-fluoro-2-(5-fluoro-2-methylphenyl)phenyl]methanamine
PubChem CID114060188
Molecular FormulaC14H13F2N
Molecular Weight233.26 g/mol
Exact Mass233.10
IUPAC Name[4-fluoro-2-(5-fluoro-2-methylphenyl)phenyl]methanamine
SMILESCc1ccc(F)cc1-c1cc(F)ccc1CN
InChIInChI=1S/C14H13F2N/c1-9-2-4-11(15)6-13(9)14-7-12(16)5-3-10(14)8-17/h2-7H,8,17H2,1H3
InChIKeySNCFUUHURLQNCC-UHFFFAOYSA-N
XLogP3.40
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.26
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze [4-fluoro-2-(5-fluoro-2-methylphenyl)phenyl]methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[2-(4-chloro-2,5-dimethylphenyl)-4-fluorophenyl]methanamine
CID 114060514
[4-(5-fluoro-2-methylphenyl)-3-methylphenyl]methanamine
CID 66479818
[4-(5-fluoro-2-methylphenyl)phenyl]methanamine
CID 61026392
(4-fluoro-2-phenylphenyl)methanamine
CID 46314898
[2-(aminomethyl)-4-fluorophenyl]methanamine
CID 44784876
ethane;4-fluoro-1-(5-fluoro-2-methylphenyl)-2-methylbenzene
CID 143449254
2-(5-chloro-2-methylphenyl)-4-fluoro-1-methylbenzene
CID 129059245
(4-fluoro-2-pyrimidin-5-ylphenyl)methanamine
CID 82506491
4-fluoro-2-(2-fluorophenyl)-1-methylbenzene
CID 46313938
[2-(2-chloro-5-fluorophenyl)-4-ethoxyphenyl]methanamine
CID 172653787
[4-fluoro-2-(2-methyltetrazol-5-yl)phenyl]methanamine
CID 21069889
(4-fluoro-2-iodophenyl)methanamine
CID 21069911

Frequently Asked Questions

What is the IUPAC name of [4-fluoro-2-(5-fluoro-2-methylphenyl)phenyl]methanamine?
The IUPAC name of [4-fluoro-2-(5-fluoro-2-methylphenyl)phenyl]methanamine (CID 114060188) is [4-fluoro-2-(5-fluoro-2-methylphenyl)phenyl]methanamine.
What is the SMILES notation for [4-fluoro-2-(5-fluoro-2-methylphenyl)phenyl]methanamine?
The canonical SMILES for [4-fluoro-2-(5-fluoro-2-methylphenyl)phenyl]methanamine is Cc1ccc(F)cc1-c1cc(F)ccc1CN.
What is the InChIKey of [4-fluoro-2-(5-fluoro-2-methylphenyl)phenyl]methanamine?
The InChIKey is SNCFUUHURLQNCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13F2N/c1-9-2-4-11(15)6-13(9)14-7-12(16)5-3-10(14)8-17/h2-7H,8,17H2,1H3.
What are the key properties of [4-fluoro-2-(5-fluoro-2-methylphenyl)phenyl]methanamine?
[4-fluoro-2-(5-fluoro-2-methylphenyl)phenyl]methanamine has a molecular weight of 233.26 g/mol, XLogP of 3.40, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [4-fluoro-2-(5-fluoro-2-methylphenyl)phenyl]methanamine is sourced from PubChem (CID 114060188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).