N-[4-(2-ethenoxyethoxy)phenyl]-4-methyl-N-(4-methylphenyl)aniline

C24H25NO2 — CID 58251088

IUPACN-[4-(2-ethenoxyethoxy)phenyl]-4-methyl-N-(4-methylphenyl)aniline
SMILESC=COCCOc1ccc(N(c2ccc(C)cc2)c2ccc(C)cc2)cc1
InChIInChI=1S/C24H25NO2/c1-4-26-17-18-27-24-15-13-23(14-16-24)25(21-9-5-19(2)6-10-21)22-11-7-20(3)8-12-22/h4-16H,1,17-18H2,2-3H3
InChIKeyMKNHLFQZCVEQBH-UHFFFAOYSA-N
MW359.47 g/mol
LogP6.31
Rot. Bonds8

About N-[4-(2-ethenoxyethoxy)phenyl]-4-methyl-N-(4-methylphenyl)aniline

N-[4-(2-ethenoxyethoxy)phenyl]-4-methyl-N-(4-methylphenyl)aniline (PubChem CID 58251088) has the molecular formula C24H25NO2 and a molecular weight of 359.47 g/mol. Its IUPAC name is N-[4-(2-ethenoxyethoxy)phenyl]-4-methyl-N-(4-methylphenyl)aniline.

Molecular Properties

Compound NameN-[4-(2-ethenoxyethoxy)phenyl]-4-methyl-N-(4-methylphenyl)aniline
PubChem CID58251088
Molecular FormulaC24H25NO2
Molecular Weight359.47 g/mol
Exact Mass359.19
IUPAC NameN-[4-(2-ethenoxyethoxy)phenyl]-4-methyl-N-(4-methylphenyl)aniline
SMILESC=COCCOc1ccc(N(c2ccc(C)cc2)c2ccc(C)cc2)cc1
InChIInChI=1S/C24H25NO2/c1-4-26-17-18-27-24-15-13-23(14-16-24)25(21-9-5-19(2)6-10-21)22-11-7-20(3)8-12-22/h4-16H,1,17-18H2,2-3H3
InChIKeyMKNHLFQZCVEQBH-UHFFFAOYSA-N
XLogP6.31
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500359.47
LogP ≤ 56.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-(2-ethenoxyethoxy)-4-methylbenzene
CID 21338012
4-[[4-(2-ethenoxyethoxy)phenyl]diazenyl]-N,N-dimethylaniline
CID 86080312
4-(4-methylphenyl)-N-phenyl-N-[4-[2-(4-prop-2-enoxyphenyl)ethoxy]phenyl]aniline
CID 58701269
1-methyl-4-[2-[2-(4-methylphenoxy)ethoxy]ethoxy]benzene
CID 22218704
N-[4-[3,5-bis[4-(N-(4-ethoxyphenyl)-4-methylanilino)phenyl]phenyl]phenyl]-N-(4-ethoxyphenyl)-4-methylaniline
CID 18716616
bis[4-(2-ethenoxyethoxy)phenyl]-phenylsulfanium
CID 59319783
4-(2-ethenoxyethoxy)benzoic acid
CID 15390034
methane;1-methyl-4-[2-(4-methylphenoxy)ethoxy]benzene;bis(1-methyl-4-[(4-methylphenoxy)methoxy]benzene)
CID 161180549
1-methoxy-4-[2-(4-methylphenoxy)ethoxy]benzene
CID 2284217
2-N,7-N-bis(4-butoxyphenyl)-2-N,7-N,9,9-tetrakis(4-methylphenyl)fluorene-2,7-diamine
CID 161284315
4-butoxy-N-[4-[4-[4-[4-(4-butoxy-N-(4-butoxyphenyl)anilino)phenoxy]phenoxy]phenoxy]phenyl]-N-(4-butoxyphenyl)aniline
CID 139670251
1-methyl-4-[2-(2-propoxyethoxy)ethoxy]benzene
CID 58462382

Frequently Asked Questions

What is the IUPAC name of N-[4-(2-ethenoxyethoxy)phenyl]-4-methyl-N-(4-methylphenyl)aniline?
The IUPAC name of N-[4-(2-ethenoxyethoxy)phenyl]-4-methyl-N-(4-methylphenyl)aniline (CID 58251088) is N-[4-(2-ethenoxyethoxy)phenyl]-4-methyl-N-(4-methylphenyl)aniline.
What is the SMILES notation for N-[4-(2-ethenoxyethoxy)phenyl]-4-methyl-N-(4-methylphenyl)aniline?
The canonical SMILES for N-[4-(2-ethenoxyethoxy)phenyl]-4-methyl-N-(4-methylphenyl)aniline is C=COCCOc1ccc(N(c2ccc(C)cc2)c2ccc(C)cc2)cc1.
What is the InChIKey of N-[4-(2-ethenoxyethoxy)phenyl]-4-methyl-N-(4-methylphenyl)aniline?
The InChIKey is MKNHLFQZCVEQBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25NO2/c1-4-26-17-18-27-24-15-13-23(14-16-24)25(21-9-5-19(2)6-10-21)22-11-7-20(3)8-12-22/h4-16H,1,17-18H2,2-3H3.
What are the key properties of N-[4-(2-ethenoxyethoxy)phenyl]-4-methyl-N-(4-methylphenyl)aniline?
N-[4-(2-ethenoxyethoxy)phenyl]-4-methyl-N-(4-methylphenyl)aniline has a molecular weight of 359.47 g/mol, XLogP of 6.31, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-ethenoxyethoxy)phenyl]-4-methyl-N-(4-methylphenyl)aniline is sourced from PubChem (CID 58251088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).