N-(3,5-dimethylphenyl)-N-(4-ethenylphenyl)-3,5-dimethylaniline

C24H25N — CID 69460355

IUPACN-(3,5-dimethylphenyl)-N-(4-ethenylphenyl)-3,5-dimethylaniline
SMILESC=Cc1ccc(N(c2cc(C)cc(C)c2)c2cc(C)cc(C)c2)cc1
InChIInChI=1S/C24H25N/c1-6-21-7-9-22(10-8-21)25(23-13-17(2)11-18(3)14-23)24-15-19(4)12-20(5)16-24/h6-16H,1H2,2-5H3
InChIKeyKNFKJDGCOUFPAQ-UHFFFAOYSA-N
MW327.47 g/mol
LogP7.03
Rot. Bonds4

About N-(3,5-dimethylphenyl)-N-(4-ethenylphenyl)-3,5-dimethylaniline

N-(3,5-dimethylphenyl)-N-(4-ethenylphenyl)-3,5-dimethylaniline (PubChem CID 69460355) has the molecular formula C24H25N and a molecular weight of 327.47 g/mol. Its IUPAC name is N-(3,5-dimethylphenyl)-N-(4-ethenylphenyl)-3,5-dimethylaniline.

Molecular Properties

Compound NameN-(3,5-dimethylphenyl)-N-(4-ethenylphenyl)-3,5-dimethylaniline
PubChem CID69460355
Molecular FormulaC24H25N
Molecular Weight327.47 g/mol
Exact Mass327.20
IUPAC NameN-(3,5-dimethylphenyl)-N-(4-ethenylphenyl)-3,5-dimethylaniline
SMILESC=Cc1ccc(N(c2cc(C)cc(C)c2)c2cc(C)cc(C)c2)cc1
InChIInChI=1S/C24H25N/c1-6-21-7-9-22(10-8-21)25(23-13-17(2)11-18(3)14-23)24-15-19(4)12-20(5)16-24/h6-16H,1H2,2-5H3
InChIKeyKNFKJDGCOUFPAQ-UHFFFAOYSA-N
XLogP7.03
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500327.47
LogP ≤ 57.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethylphenyl)-N-(4-ethenylphenyl)-3,5-dimethylaniline?
The IUPAC name of N-(3,5-dimethylphenyl)-N-(4-ethenylphenyl)-3,5-dimethylaniline (CID 69460355) is N-(3,5-dimethylphenyl)-N-(4-ethenylphenyl)-3,5-dimethylaniline.
What is the SMILES notation for N-(3,5-dimethylphenyl)-N-(4-ethenylphenyl)-3,5-dimethylaniline?
The canonical SMILES for N-(3,5-dimethylphenyl)-N-(4-ethenylphenyl)-3,5-dimethylaniline is C=Cc1ccc(N(c2cc(C)cc(C)c2)c2cc(C)cc(C)c2)cc1.
What is the InChIKey of N-(3,5-dimethylphenyl)-N-(4-ethenylphenyl)-3,5-dimethylaniline?
The InChIKey is KNFKJDGCOUFPAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N/c1-6-21-7-9-22(10-8-21)25(23-13-17(2)11-18(3)14-23)24-15-19(4)12-20(5)16-24/h6-16H,1H2,2-5H3.
What are the key properties of N-(3,5-dimethylphenyl)-N-(4-ethenylphenyl)-3,5-dimethylaniline?
N-(3,5-dimethylphenyl)-N-(4-ethenylphenyl)-3,5-dimethylaniline has a molecular weight of 327.47 g/mol, XLogP of 7.03, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethylphenyl)-N-(4-ethenylphenyl)-3,5-dimethylaniline is sourced from PubChem (CID 69460355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).