(3-fluoro-5-methylphenyl)-(4-methylphenyl)methanamine

C15H16FN — CID 79704327

IUPAC(3-fluoro-5-methylphenyl)-(4-methylphenyl)methanamine
SMILESCc1ccc(C(N)c2cc(C)cc(F)c2)cc1
InChIInChI=1S/C15H16FN/c1-10-3-5-12(6-4-10)15(17)13-7-11(2)8-14(16)9-13/h3-9,15H,17H2,1-2H3
InChIKeyFUUKCOMIRPPDFQ-UHFFFAOYSA-N
MW229.30 g/mol
LogP3.49
Rot. Bonds2

About (3-fluoro-5-methylphenyl)-(4-methylphenyl)methanamine

(3-fluoro-5-methylphenyl)-(4-methylphenyl)methanamine (PubChem CID 79704327) has the molecular formula C15H16FN and a molecular weight of 229.30 g/mol. Its IUPAC name is (3-fluoro-5-methylphenyl)-(4-methylphenyl)methanamine.

Molecular Properties

Compound Name(3-fluoro-5-methylphenyl)-(4-methylphenyl)methanamine
PubChem CID79704327
Molecular FormulaC15H16FN
Molecular Weight229.30 g/mol
Exact Mass229.13
IUPAC Name(3-fluoro-5-methylphenyl)-(4-methylphenyl)methanamine
SMILESCc1ccc(C(N)c2cc(C)cc(F)c2)cc1
InChIInChI=1S/C15H16FN/c1-10-3-5-12(6-4-10)15(17)13-7-11(2)8-14(16)9-13/h3-9,15H,17H2,1-2H3
InChIKeyFUUKCOMIRPPDFQ-UHFFFAOYSA-N
XLogP3.49
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.30
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(3-fluoro-5-methylphenyl)-[4-(trifluoromethoxy)phenyl]methanamine
CID 105016494
(4-chloro-3-fluorophenyl)-(3-fluoro-5-methylphenyl)methanamine
CID 107994515
bis(3,5-dimethylphenyl)methanamine
CID 115796405
1-(3-fluoro-5-methylphenyl)-N-methyl-1-(4-methylphenyl)methanamine
CID 79704486
3-[amino-(3-fluoro-5-methylphenyl)methyl]-N,N-dimethylaniline
CID 105169951
(4-fluoro-2-iodophenyl)-(3-fluoro-5-methylphenyl)methanamine
CID 114030220
(4-fluorophenyl)-(5-methyl-3-pyridinyl)methanamine
CID 115374243
bis(4-fluorophenyl)methanamine
CID 10955039
(3,4-dimethylphenyl)-(3,5-dimethylphenyl)methanamine
CID 43149143
1-(3-fluoro-5-methylphenyl)propan-1-amine
CID 55282781
[(3,5-difluorophenyl)-(4-methylphenyl)methyl]hydrazine
CID 105194421
(4-methoxy-3,5-dimethylphenyl)-(4-methylphenyl)methanamine
CID 83056835

Frequently Asked Questions

What is the IUPAC name of (3-fluoro-5-methylphenyl)-(4-methylphenyl)methanamine?
The IUPAC name of (3-fluoro-5-methylphenyl)-(4-methylphenyl)methanamine (CID 79704327) is (3-fluoro-5-methylphenyl)-(4-methylphenyl)methanamine.
What is the SMILES notation for (3-fluoro-5-methylphenyl)-(4-methylphenyl)methanamine?
The canonical SMILES for (3-fluoro-5-methylphenyl)-(4-methylphenyl)methanamine is Cc1ccc(C(N)c2cc(C)cc(F)c2)cc1.
What is the InChIKey of (3-fluoro-5-methylphenyl)-(4-methylphenyl)methanamine?
The InChIKey is FUUKCOMIRPPDFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FN/c1-10-3-5-12(6-4-10)15(17)13-7-11(2)8-14(16)9-13/h3-9,15H,17H2,1-2H3.
What are the key properties of (3-fluoro-5-methylphenyl)-(4-methylphenyl)methanamine?
(3-fluoro-5-methylphenyl)-(4-methylphenyl)methanamine has a molecular weight of 229.30 g/mol, XLogP of 3.49, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3-fluoro-5-methylphenyl)-(4-methylphenyl)methanamine is sourced from PubChem (CID 79704327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).