1-(4-amino-2-methoxyphenyl)ethenol

C9H11NO2 — CID 89240422

IUPAC1-(4-amino-2-methoxyphenyl)ethenol
SMILESC=C(O)c1ccc(N)cc1OC
InChIInChI=1S/C9H11NO2/c1-6(11)8-4-3-7(10)5-9(8)12-2/h3-5,11H,1,10H2,2H3
InChIKeyBZJJSSIIJAATNC-UHFFFAOYSA-N
MW165.19 g/mol
LogP1.81
Rot. Bonds2

About 1-(4-amino-2-methoxyphenyl)ethenol

1-(4-amino-2-methoxyphenyl)ethenol (PubChem CID 89240422) has the molecular formula C9H11NO2 and a molecular weight of 165.19 g/mol. Its IUPAC name is 1-(4-amino-2-methoxyphenyl)ethenol.

Molecular Properties

Compound Name1-(4-amino-2-methoxyphenyl)ethenol
PubChem CID89240422
Molecular FormulaC9H11NO2
Molecular Weight165.19 g/mol
Exact Mass165.08
IUPAC Name1-(4-amino-2-methoxyphenyl)ethenol
SMILESC=C(O)c1ccc(N)cc1OC
InChIInChI=1S/C9H11NO2/c1-6(11)8-4-3-7(10)5-9(8)12-2/h3-5,11H,1,10H2,2H3
InChIKeyBZJJSSIIJAATNC-UHFFFAOYSA-N
XLogP1.81
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.19
LogP ≤ 51.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-(4-amino-2-methoxyphenyl)-3-oxopropanoic acid
CID 146619681
4-[(Z)-2-amino-1-methoxyethenyl]-3-methoxyaniline
CID 142018135
2-[(4-amino-2-methoxybenzoyl)amino]acetic acid
CID 107207731
(2R)-2-[(4-amino-2-methoxybenzoyl)amino]propanoic acid
CID 107207808
(4-amino-2-methoxyphenyl)-(2-methoxy-5-methylphenyl)methanone
CID 104784994
2-(5-amino-2-methoxyphenoxy)acetic acid
CID 59419305
1-(4-amino-2-fluoro-5-methoxyphenyl)ethenol
CID 156712123
3-[(4-amino-2-methoxybenzoyl)amino]-2,2,3-trimethylbutanoic acid
CID 107207865
(4-amino-2-methoxyphenyl)-(3-methoxythiophen-2-yl)methanone
CID 113452764
4-[(4-amino-2-methoxybenzoyl)amino]butanoic acid
CID 107207734
4-methoxy-3-propan-2-yloxyaniline
CID 16785912
2-[(4-amino-2-methoxybenzoyl)amino]pent-4-enoic acid
CID 107207977

Frequently Asked Questions

What is the IUPAC name of 1-(4-amino-2-methoxyphenyl)ethenol?
The IUPAC name of 1-(4-amino-2-methoxyphenyl)ethenol (CID 89240422) is 1-(4-amino-2-methoxyphenyl)ethenol.
What is the SMILES notation for 1-(4-amino-2-methoxyphenyl)ethenol?
The canonical SMILES for 1-(4-amino-2-methoxyphenyl)ethenol is C=C(O)c1ccc(N)cc1OC.
What is the InChIKey of 1-(4-amino-2-methoxyphenyl)ethenol?
The InChIKey is BZJJSSIIJAATNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11NO2/c1-6(11)8-4-3-7(10)5-9(8)12-2/h3-5,11H,1,10H2,2H3.
What are the key properties of 1-(4-amino-2-methoxyphenyl)ethenol?
1-(4-amino-2-methoxyphenyl)ethenol has a molecular weight of 165.19 g/mol, XLogP of 1.81, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-amino-2-methoxyphenyl)ethenol is sourced from PubChem (CID 89240422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).