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

C16H19N — CID 66480214

IUPAC[4-(3,5-dimethylphenyl)-3-methylphenyl]methanamine
SMILESCc1cc(C)cc(-c2ccc(CN)cc2C)c1
InChIInChI=1S/C16H19N/c1-11-6-12(2)8-15(7-11)16-5-4-14(10-17)9-13(16)3/h4-9H,10,17H2,1-3H3
InChIKeyGXUDWBIHUCVZAE-UHFFFAOYSA-N
MW225.33 g/mol
LogP3.74
Rot. Bonds2

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

[4-(3,5-dimethylphenyl)-3-methylphenyl]methanamine (PubChem CID 66480214) has the molecular formula C16H19N and a molecular weight of 225.33 g/mol. Its IUPAC name is [4-(3,5-dimethylphenyl)-3-methylphenyl]methanamine.

Molecular Properties

Compound Name[4-(3,5-dimethylphenyl)-3-methylphenyl]methanamine
PubChem CID66480214
Molecular FormulaC16H19N
Molecular Weight225.33 g/mol
Exact Mass225.15
IUPAC Name[4-(3,5-dimethylphenyl)-3-methylphenyl]methanamine
SMILESCc1cc(C)cc(-c2ccc(CN)cc2C)c1
InChIInChI=1S/C16H19N/c1-11-6-12(2)8-15(7-11)16-5-4-14(10-17)9-13(16)3/h4-9H,10,17H2,1-3H3
InChIKeyGXUDWBIHUCVZAE-UHFFFAOYSA-N
XLogP3.74
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.33
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of [4-(3,5-dimethylphenyl)-3-methylphenyl]methanamine?
The IUPAC name of [4-(3,5-dimethylphenyl)-3-methylphenyl]methanamine (CID 66480214) is [4-(3,5-dimethylphenyl)-3-methylphenyl]methanamine.
What is the SMILES notation for [4-(3,5-dimethylphenyl)-3-methylphenyl]methanamine?
The canonical SMILES for [4-(3,5-dimethylphenyl)-3-methylphenyl]methanamine is Cc1cc(C)cc(-c2ccc(CN)cc2C)c1.
What is the InChIKey of [4-(3,5-dimethylphenyl)-3-methylphenyl]methanamine?
The InChIKey is GXUDWBIHUCVZAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N/c1-11-6-12(2)8-15(7-11)16-5-4-14(10-17)9-13(16)3/h4-9H,10,17H2,1-3H3.
What are the key properties of [4-(3,5-dimethylphenyl)-3-methylphenyl]methanamine?
[4-(3,5-dimethylphenyl)-3-methylphenyl]methanamine has a molecular weight of 225.33 g/mol, XLogP of 3.74, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(3,5-dimethylphenyl)-3-methylphenyl]methanamine is sourced from PubChem (CID 66480214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).