N-(4-ethenylphenyl)-4-methoxy-N-(4-methoxy-3-methylphenyl)-3-methylaniline

C24H25NO2 — CID 69462200

IUPACN-(4-ethenylphenyl)-4-methoxy-N-(4-methoxy-3-methylphenyl)-3-methylaniline
SMILESC=Cc1ccc(N(c2ccc(OC)c(C)c2)c2ccc(OC)c(C)c2)cc1
InChIInChI=1S/C24H25NO2/c1-6-19-7-9-20(10-8-19)25(21-11-13-23(26-4)17(2)15-21)22-12-14-24(27-5)18(3)16-22/h6-16H,1H2,2-5H3
InChIKeySVGSEANTJOZTNK-UHFFFAOYSA-N
MW359.47 g/mol
LogP6.43
Rot. Bonds6

About N-(4-ethenylphenyl)-4-methoxy-N-(4-methoxy-3-methylphenyl)-3-methylaniline

N-(4-ethenylphenyl)-4-methoxy-N-(4-methoxy-3-methylphenyl)-3-methylaniline (PubChem CID 69462200) has the molecular formula C24H25NO2 and a molecular weight of 359.47 g/mol. Its IUPAC name is N-(4-ethenylphenyl)-4-methoxy-N-(4-methoxy-3-methylphenyl)-3-methylaniline.

Molecular Properties

Compound NameN-(4-ethenylphenyl)-4-methoxy-N-(4-methoxy-3-methylphenyl)-3-methylaniline
PubChem CID69462200
Molecular FormulaC24H25NO2
Molecular Weight359.47 g/mol
Exact Mass359.19
IUPAC NameN-(4-ethenylphenyl)-4-methoxy-N-(4-methoxy-3-methylphenyl)-3-methylaniline
SMILESC=Cc1ccc(N(c2ccc(OC)c(C)c2)c2ccc(OC)c(C)c2)cc1
InChIInChI=1S/C24H25NO2/c1-6-19-7-9-20(10-8-19)25(21-11-13-23(26-4)17(2)15-21)22-12-14-24(27-5)18(3)16-22/h6-16H,1H2,2-5H3
InChIKeySVGSEANTJOZTNK-UHFFFAOYSA-N
XLogP6.43
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500359.47
LogP ≤ 56.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4-ethenylphenyl)-4-methoxy-N-(4-methoxy-3-methylphenyl)-3-methylaniline?
The IUPAC name of N-(4-ethenylphenyl)-4-methoxy-N-(4-methoxy-3-methylphenyl)-3-methylaniline (CID 69462200) is N-(4-ethenylphenyl)-4-methoxy-N-(4-methoxy-3-methylphenyl)-3-methylaniline.
What is the SMILES notation for N-(4-ethenylphenyl)-4-methoxy-N-(4-methoxy-3-methylphenyl)-3-methylaniline?
The canonical SMILES for N-(4-ethenylphenyl)-4-methoxy-N-(4-methoxy-3-methylphenyl)-3-methylaniline is C=Cc1ccc(N(c2ccc(OC)c(C)c2)c2ccc(OC)c(C)c2)cc1.
What is the InChIKey of N-(4-ethenylphenyl)-4-methoxy-N-(4-methoxy-3-methylphenyl)-3-methylaniline?
The InChIKey is SVGSEANTJOZTNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25NO2/c1-6-19-7-9-20(10-8-19)25(21-11-13-23(26-4)17(2)15-21)22-12-14-24(27-5)18(3)16-22/h6-16H,1H2,2-5H3.
What are the key properties of N-(4-ethenylphenyl)-4-methoxy-N-(4-methoxy-3-methylphenyl)-3-methylaniline?
N-(4-ethenylphenyl)-4-methoxy-N-(4-methoxy-3-methylphenyl)-3-methylaniline has a molecular weight of 359.47 g/mol, XLogP of 6.43, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethenylphenyl)-4-methoxy-N-(4-methoxy-3-methylphenyl)-3-methylaniline is sourced from PubChem (CID 69462200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).