4-[2-(4-methoxyanilino)ethoxy]phenol

C15H17NO3 — CID 71735773

IUPAC4-[2-(4-methoxyanilino)ethoxy]phenol
SMILESCOc1ccc(NCCOc2ccc(O)cc2)cc1
InChIInChI=1S/C15H17NO3/c1-18-14-6-2-12(3-7-14)16-10-11-19-15-8-4-13(17)5-9-15/h2-9,16-17H,10-11H2,1H3
InChIKeyXIUMHNURBFTARA-UHFFFAOYSA-N
MW259.31 g/mol
LogP2.89
Rot. Bonds6

About 4-[2-(4-methoxyanilino)ethoxy]phenol

4-[2-(4-methoxyanilino)ethoxy]phenol (PubChem CID 71735773) has the molecular formula C15H17NO3 and a molecular weight of 259.31 g/mol. Its IUPAC name is 4-[2-(4-methoxyanilino)ethoxy]phenol.

Molecular Properties

Compound Name4-[2-(4-methoxyanilino)ethoxy]phenol
PubChem CID71735773
Molecular FormulaC15H17NO3
Molecular Weight259.31 g/mol
Exact Mass259.12
IUPAC Name4-[2-(4-methoxyanilino)ethoxy]phenol
SMILESCOc1ccc(NCCOc2ccc(O)cc2)cc1
InChIInChI=1S/C15H17NO3/c1-18-14-6-2-12(3-7-14)16-10-11-19-15-8-4-13(17)5-9-15/h2-9,16-17H,10-11H2,1H3
InChIKeyXIUMHNURBFTARA-UHFFFAOYSA-N
XLogP2.89
TPSA50.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 52.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

4-methoxy-N-(2-phenoxyethyl)aniline
CID 39347663
4-iodo-N-[2-(4-methoxyphenoxy)ethyl]aniline
CID 60679168
N-[2-(4-methoxyphenoxy)ethyl]-4-methylsulfanylaniline
CID 60681036
4-methoxy-N-[3-[6-[3-(4-methoxyanilino)propoxy]naphthalen-2-yl]oxypropyl]aniline
CID 10096933
4-methyl-N-[2-(4-methylphenoxy)ethyl]aniline
CID 4072797
4-methoxy-N-(3-methoxypropyl)aniline
CID 60925973
N-[2-(4-chloro-3,5-dimethylphenoxy)ethyl]-4-methoxyaniline
CID 54796773
3-[2-(4-methoxyanilino)ethoxy]benzoic acid
CID 103234904
[3-[2-(4-methoxyphenoxy)ethylamino]phenyl]methanol
CID 110880288
3-(4-bromoanilino)-N-[2-(4-methoxyphenoxy)ethyl]propanamide
CID 109031057
N-[2-(4-methoxyphenoxy)ethyl]-3-propan-2-yloxyaniline
CID 54802827
N-[2-(4-methoxyphenoxy)ethyl]-1-benzothiophen-5-amine
CID 60728035

Frequently Asked Questions

What is the IUPAC name of 4-[2-(4-methoxyanilino)ethoxy]phenol?
The IUPAC name of 4-[2-(4-methoxyanilino)ethoxy]phenol (CID 71735773) is 4-[2-(4-methoxyanilino)ethoxy]phenol.
What is the SMILES notation for 4-[2-(4-methoxyanilino)ethoxy]phenol?
The canonical SMILES for 4-[2-(4-methoxyanilino)ethoxy]phenol is COc1ccc(NCCOc2ccc(O)cc2)cc1.
What is the InChIKey of 4-[2-(4-methoxyanilino)ethoxy]phenol?
The InChIKey is XIUMHNURBFTARA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO3/c1-18-14-6-2-12(3-7-14)16-10-11-19-15-8-4-13(17)5-9-15/h2-9,16-17H,10-11H2,1H3.
What are the key properties of 4-[2-(4-methoxyanilino)ethoxy]phenol?
4-[2-(4-methoxyanilino)ethoxy]phenol has a molecular weight of 259.31 g/mol, XLogP of 2.89, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(4-methoxyanilino)ethoxy]phenol is sourced from PubChem (CID 71735773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).