2-methoxy-6-[1-[3-(2-phenylethoxy)anilino]ethenyl]phenol

C23H23NO3 — CID 142852821

IUPAC2-methoxy-6-[1-[3-(2-phenylethoxy)anilino]ethenyl]phenol
SMILESC=C(Nc1cccc(OCCc2ccccc2)c1)c1cccc(OC)c1O
InChIInChI=1S/C23H23NO3/c1-17(21-12-7-13-22(26-2)23(21)25)24-19-10-6-11-20(16-19)27-15-14-18-8-4-3-5-9-18/h3-13,16,24-25H,1,14-15H2,2H3
InChIKeyPUUVYHORYOPBGC-UHFFFAOYSA-N
MW361.44 g/mol
LogP5.11
Rot. Bonds8

About 2-methoxy-6-[1-[3-(2-phenylethoxy)anilino]ethenyl]phenol

2-methoxy-6-[1-[3-(2-phenylethoxy)anilino]ethenyl]phenol (PubChem CID 142852821) has the molecular formula C23H23NO3 and a molecular weight of 361.44 g/mol. Its IUPAC name is 2-methoxy-6-[1-[3-(2-phenylethoxy)anilino]ethenyl]phenol.

Molecular Properties

Compound Name2-methoxy-6-[1-[3-(2-phenylethoxy)anilino]ethenyl]phenol
PubChem CID142852821
Molecular FormulaC23H23NO3
Molecular Weight361.44 g/mol
Exact Mass361.17
IUPAC Name2-methoxy-6-[1-[3-(2-phenylethoxy)anilino]ethenyl]phenol
SMILESC=C(Nc1cccc(OCCc2ccccc2)c1)c1cccc(OC)c1O
InChIInChI=1S/C23H23NO3/c1-17(21-12-7-13-22(26-2)23(21)25)24-19-10-6-11-20(16-19)27-15-14-18-8-4-3-5-9-18/h3-13,16,24-25H,1,14-15H2,2H3
InChIKeyPUUVYHORYOPBGC-UHFFFAOYSA-N
XLogP5.11
TPSA50.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500361.44
LogP ≤ 55.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-ethenyl-3-[1-[3-(2-phenylethoxy)anilino]ethenyl]phenyl]acetamide
CID 142852975
2-(2-phenylethoxy)-N-[3-(2-phenylethoxy)phenyl]benzamide
CID 17142269
2-(2-methoxyanilino)-N-[3-(2-phenylethoxy)phenyl]acetamide
CID 54817560
5-bromo-2-methoxy-N-[3-(2-phenylethoxy)phenyl]benzamide
CID 17142257
methyl 3-oxo-3-[3-(2-phenylethoxy)anilino]propanoate
CID 28638067
N-[[3-(2-phenoxyethoxy)phenyl]carbamothioyl]-2-(2-phenylethoxy)benzamide
CID 19628562
2-(3-methylbutoxy)-N-[3-(2-phenylethoxy)phenyl]benzamide
CID 17142197
N-[3-(2-methoxyethoxy)phenyl]-4-(2-phenylethoxy)benzamide
CID 17169886
3-methoxy-N-[[3-(2-phenylethoxy)phenyl]methyl]aniline
CID 54797531
2-(2-phenylethoxy)-N-(3-propan-2-yloxyphenyl)benzamide
CID 17154818
2-phenyl-N-[[3-(2-phenylethoxy)phenyl]carbamothioyl]acetamide
CID 17142302
N-[[3-(3-methylbutoxy)phenyl]carbamothioyl]-2-(2-phenylethoxy)benzamide
CID 19628556

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-6-[1-[3-(2-phenylethoxy)anilino]ethenyl]phenol?
The IUPAC name of 2-methoxy-6-[1-[3-(2-phenylethoxy)anilino]ethenyl]phenol (CID 142852821) is 2-methoxy-6-[1-[3-(2-phenylethoxy)anilino]ethenyl]phenol.
What is the SMILES notation for 2-methoxy-6-[1-[3-(2-phenylethoxy)anilino]ethenyl]phenol?
The canonical SMILES for 2-methoxy-6-[1-[3-(2-phenylethoxy)anilino]ethenyl]phenol is C=C(Nc1cccc(OCCc2ccccc2)c1)c1cccc(OC)c1O.
What is the InChIKey of 2-methoxy-6-[1-[3-(2-phenylethoxy)anilino]ethenyl]phenol?
The InChIKey is PUUVYHORYOPBGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23NO3/c1-17(21-12-7-13-22(26-2)23(21)25)24-19-10-6-11-20(16-19)27-15-14-18-8-4-3-5-9-18/h3-13,16,24-25H,1,14-15H2,2H3.
What are the key properties of 2-methoxy-6-[1-[3-(2-phenylethoxy)anilino]ethenyl]phenol?
2-methoxy-6-[1-[3-(2-phenylethoxy)anilino]ethenyl]phenol has a molecular weight of 361.44 g/mol, XLogP of 5.11, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-6-[1-[3-(2-phenylethoxy)anilino]ethenyl]phenol is sourced from PubChem (CID 142852821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).