[4-(3,5-difluorophenyl)-3-methylphenyl]methanamine

C14H13F2N — CID 66479617

IUPAC[4-(3,5-difluorophenyl)-3-methylphenyl]methanamine
SMILESCc1cc(CN)ccc1-c1cc(F)cc(F)c1
InChIInChI=1S/C14H13F2N/c1-9-4-10(8-17)2-3-14(9)11-5-12(15)7-13(16)6-11/h2-7H,8,17H2,1H3
InChIKeyHYSNXPFPZWEVGO-UHFFFAOYSA-N
MW233.26 g/mol
LogP3.40
Rot. Bonds2

About [4-(3,5-difluorophenyl)-3-methylphenyl]methanamine

[4-(3,5-difluorophenyl)-3-methylphenyl]methanamine (PubChem CID 66479617) has the molecular formula C14H13F2N and a molecular weight of 233.26 g/mol. Its IUPAC name is [4-(3,5-difluorophenyl)-3-methylphenyl]methanamine.

Molecular Properties

Compound Name[4-(3,5-difluorophenyl)-3-methylphenyl]methanamine
PubChem CID66479617
Molecular FormulaC14H13F2N
Molecular Weight233.26 g/mol
Exact Mass233.10
IUPAC Name[4-(3,5-difluorophenyl)-3-methylphenyl]methanamine
SMILESCc1cc(CN)ccc1-c1cc(F)cc(F)c1
InChIInChI=1S/C14H13F2N/c1-9-4-10(8-17)2-3-14(9)11-5-12(15)7-13(16)6-11/h2-7H,8,17H2,1H3
InChIKeyHYSNXPFPZWEVGO-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-(3,5-difluorophenyl)-3-methylphenyl]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

[4-(3,5-dimethylphenyl)-3-methylphenyl]methanamine
CID 66480214
[4-(5-fluoro-2-methylphenyl)-3-methylphenyl]methanamine
CID 66479818
[4-(4-ethylphenyl)-3-methylphenyl]methanamine
CID 66481033
[3-methyl-4-(2,4,5-trimethylphenyl)phenyl]methanamine
CID 66479645
[4-fluoro-3-(4-fluoro-2-methylphenyl)phenyl]methanamine
CID 54911954
1-[4-(3-fluoro-5-methylphenyl)-3-methylphenyl]-N-methylmethanamine
CID 79690685
N-[[4-(3,5-difluorophenyl)-3-methylphenyl]methyl]cyclopropanamine
CID 66479615
[4-(3-fluoro-2-methylphenyl)-3-methylphenyl]methanamine
CID 115502881
4-[4-(aminomethyl)-2-methylphenyl]-N,N-dimethylaniline
CID 66481798
N-[[4-(3-fluoro-5-methylphenyl)-3-methylphenyl]methyl]propan-2-amine
CID 79692007
[4-(2,3-dihydro-1H-inden-5-yl)-3-methylphenyl]methanamine
CID 66481637
[3-(3-chloro-5-fluorophenyl)-4-fluorophenyl]methanamine
CID 113324837

Frequently Asked Questions

What is the IUPAC name of [4-(3,5-difluorophenyl)-3-methylphenyl]methanamine?
The IUPAC name of [4-(3,5-difluorophenyl)-3-methylphenyl]methanamine (CID 66479617) is [4-(3,5-difluorophenyl)-3-methylphenyl]methanamine.
What is the SMILES notation for [4-(3,5-difluorophenyl)-3-methylphenyl]methanamine?
The canonical SMILES for [4-(3,5-difluorophenyl)-3-methylphenyl]methanamine is Cc1cc(CN)ccc1-c1cc(F)cc(F)c1.
What is the InChIKey of [4-(3,5-difluorophenyl)-3-methylphenyl]methanamine?
The InChIKey is HYSNXPFPZWEVGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13F2N/c1-9-4-10(8-17)2-3-14(9)11-5-12(15)7-13(16)6-11/h2-7H,8,17H2,1H3.
What are the key properties of [4-(3,5-difluorophenyl)-3-methylphenyl]methanamine?
[4-(3,5-difluorophenyl)-3-methylphenyl]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-(3,5-difluorophenyl)-3-methylphenyl]methanamine is sourced from PubChem (CID 66479617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).