2-(2-hydroxyethylamino)-6-methylphenol

C9H13NO2 — CID 68893139

IUPAC2-(2-hydroxyethylamino)-6-methylphenol
SMILESCc1cccc(NCCO)c1O
InChIInChI=1S/C9H13NO2/c1-7-3-2-4-8(9(7)12)10-5-6-11/h2-4,10-12H,5-6H2,1H3
InChIKeyYDCFAUPBLAIZAJ-UHFFFAOYSA-N
MW167.21 g/mol
LogP1.10
Rot. Bonds3

About 2-(2-hydroxyethylamino)-6-methylphenol

2-(2-hydroxyethylamino)-6-methylphenol (PubChem CID 68893139) has the molecular formula C9H13NO2 and a molecular weight of 167.21 g/mol. Its IUPAC name is 2-(2-hydroxyethylamino)-6-methylphenol.

Molecular Properties

Compound Name2-(2-hydroxyethylamino)-6-methylphenol
PubChem CID68893139
Molecular FormulaC9H13NO2
Molecular Weight167.21 g/mol
Exact Mass167.09
IUPAC Name2-(2-hydroxyethylamino)-6-methylphenol
SMILESCc1cccc(NCCO)c1O
InChIInChI=1S/C9H13NO2/c1-7-3-2-4-8(9(7)12)10-5-6-11/h2-4,10-12H,5-6H2,1H3
InChIKeyYDCFAUPBLAIZAJ-UHFFFAOYSA-N
XLogP1.10
TPSA52.49 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.21
LogP ≤ 51.10
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-(2-hydroxyethylamino)benzene-1,2-diol
CID 70502073
3-(2-methylanilino)propan-1-ol
CID 18005925
3-(4-hydroxybutylamino)benzene-1,2-diol
CID 54456176
2-[(2-methyl-3-pyridinyl)amino]ethanol
CID 18349954
2-[3-(2-hydroxyethylamino)-2-(methoxymethyl)anilino]ethanol
CID 91146715
2-(2-hydroxyethylamino)ethanol;1,2-xylene
CID 174810256
2-(2-butylanilino)ethanol
CID 139597188
2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)ethanol
CID 28573020
2-(2,3-dimethoxyanilino)ethanol
CID 174734615
2-[2-(aminomethyl)-6-methylanilino]ethanol
CID 107105672
2-[2-(2-amino-3-methylphenyl)hydrazinyl]ethanol
CID 101291105
2-(2-iodoanilino)ethanol
CID 28978311

Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxyethylamino)-6-methylphenol?
The IUPAC name of 2-(2-hydroxyethylamino)-6-methylphenol (CID 68893139) is 2-(2-hydroxyethylamino)-6-methylphenol.
What is the SMILES notation for 2-(2-hydroxyethylamino)-6-methylphenol?
The canonical SMILES for 2-(2-hydroxyethylamino)-6-methylphenol is Cc1cccc(NCCO)c1O.
What is the InChIKey of 2-(2-hydroxyethylamino)-6-methylphenol?
The InChIKey is YDCFAUPBLAIZAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NO2/c1-7-3-2-4-8(9(7)12)10-5-6-11/h2-4,10-12H,5-6H2,1H3.
What are the key properties of 2-(2-hydroxyethylamino)-6-methylphenol?
2-(2-hydroxyethylamino)-6-methylphenol has a molecular weight of 167.21 g/mol, XLogP of 1.10, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxyethylamino)-6-methylphenol is sourced from PubChem (CID 68893139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).