2-amino-4-methoxyphenol

C7H9NO2 — CID 1419108

IUPAC2-amino-4-methoxyphenol
SMILESCOc1ccc(O)c(N)c1
InChIInChI=1S/C7H9NO2/c1-10-5-2-3-7(9)6(8)4-5/h2-4,9H,8H2,1H3
InChIKeyTUADYTFWZPZZTP-UHFFFAOYSA-N
MW139.15 g/mol
LogP0.98
Rot. Bonds1

About 2-amino-4-methoxyphenol

2-amino-4-methoxyphenol (PubChem CID 1419108) has the molecular formula C7H9NO2 and a molecular weight of 139.15 g/mol. Its IUPAC name is 2-amino-4-methoxyphenol.

Molecular Properties

Compound Name2-amino-4-methoxyphenol
PubChem CID1419108
Molecular FormulaC7H9NO2
Molecular Weight139.15 g/mol
Exact Mass139.06
IUPAC Name2-amino-4-methoxyphenol
SMILESCOc1ccc(O)c(N)c1
InChIInChI=1S/C7H9NO2/c1-10-5-2-3-7(9)6(8)4-5/h2-4,9H,8H2,1H3
InChIKeyTUADYTFWZPZZTP-UHFFFAOYSA-N
XLogP0.98
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.15
LogP ≤ 50.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'catechol', 'substructure': 'N/A'}

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Related Compounds

3-Methoxyaniline
CID 10824
2,5-Diaminoanisole
CID 21379
2-Methoxyaniline
CID 7000
2,5-Dimethoxyaniline
CID 7613
1,4-Benzenediamine, 2-methoxy-, sulfate
CID 92374
Benzenamine, 2,5-diethoxy-
CID 66756
4-Aminoguaiacol
CID 101296
5-Amino-2-methoxyphenol
CID 74314
3-Methoxybenzene-1,2-diamine
CID 184268
Phenol, 4-methoxy-2-nitro-
CID 15285
4-Methoxy-3-nitrophenol
CID 14958907
N-(2,5-dimethoxyphenyl)imidodicarbonimidic diamide
CID 2968809

Frequently Asked Questions

What is the IUPAC name of 2-amino-4-methoxyphenol?
The IUPAC name of 2-amino-4-methoxyphenol (CID 1419108) is 2-amino-4-methoxyphenol.
What is the SMILES notation for 2-amino-4-methoxyphenol?
The canonical SMILES for 2-amino-4-methoxyphenol is COc1ccc(O)c(N)c1.
What is the InChIKey of 2-amino-4-methoxyphenol?
The InChIKey is TUADYTFWZPZZTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9NO2/c1-10-5-2-3-7(9)6(8)4-5/h2-4,9H,8H2,1H3.
What are the key properties of 2-amino-4-methoxyphenol?
2-amino-4-methoxyphenol has a molecular weight of 139.15 g/mol, XLogP of 0.98, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4-methoxyphenol is sourced from PubChem (CID 1419108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).