2-amino-6-[2-(methylamino)ethoxy]phenol

C9H14N2O2 — CID 58657538

IUPAC2-amino-6-[2-(methylamino)ethoxy]phenol
SMILESCNCCOc1cccc(N)c1O
InChIInChI=1S/C9H14N2O2/c1-11-5-6-13-8-4-2-3-7(10)9(8)12/h2-4,11-12H,5-6,10H2,1H3
InChIKeyYSBHFYZQHWZJSQ-UHFFFAOYSA-N
MW182.22 g/mol
LogP0.57
Rot. Bonds4

About 2-amino-6-[2-(methylamino)ethoxy]phenol

2-amino-6-[2-(methylamino)ethoxy]phenol (PubChem CID 58657538) has the molecular formula C9H14N2O2 and a molecular weight of 182.22 g/mol. Its IUPAC name is 2-amino-6-[2-(methylamino)ethoxy]phenol.

Molecular Properties

Compound Name2-amino-6-[2-(methylamino)ethoxy]phenol
PubChem CID58657538
Molecular FormulaC9H14N2O2
Molecular Weight182.22 g/mol
Exact Mass182.11
IUPAC Name2-amino-6-[2-(methylamino)ethoxy]phenol
SMILESCNCCOc1cccc(N)c1O
InChIInChI=1S/C9H14N2O2/c1-11-5-6-13-8-4-2-3-7(10)9(8)12/h2-4,11-12H,5-6,10H2,1H3
InChIKeyYSBHFYZQHWZJSQ-UHFFFAOYSA-N
XLogP0.57
TPSA67.51 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.22
LogP ≤ 50.57
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-[3-[3-(2,3-dihydroxyphenoxy)propylamino]propoxy]benzene-1,2-diol
CID 14815710
N-methyl-2-(2-methylphenoxy)ethanamine;hydrochloride
CID 17178031
2-(2-methoxyphenoxy)-N-methylethanamine;hydrochloride
CID 19749083
3-[2-(methylamino)ethoxy]phenol
CID 83619980
2-(2-ethylphenoxy)-N-methylethanamine;hydrochloride
CID 44665206
2-[2-(2-hydroxy-3-methylphenoxy)ethoxy]-6-methylphenol
CID 174709972
methyl 2-[2-[2-(methylamino)ethoxy]phenyl]acetate
CID 117054245
1-[2-[2-(methylamino)ethoxy]phenyl]cyclopropan-1-amine
CID 141324202
2-(2-benzylphenoxy)-N-methylethanamine
CID 12660328
1-N-methyl-6-[2-(methylamino)ethoxy]benzene-1,2,4-triamine
CID 138705209
N-methyl-2-(2-methyl-3-nitrophenoxy)ethanamine
CID 43437970
N-methyl-3-naphthalen-1-yloxypropan-1-amine;oxalic acid
CID 2949357

Frequently Asked Questions

What is the IUPAC name of 2-amino-6-[2-(methylamino)ethoxy]phenol?
The IUPAC name of 2-amino-6-[2-(methylamino)ethoxy]phenol (CID 58657538) is 2-amino-6-[2-(methylamino)ethoxy]phenol.
What is the SMILES notation for 2-amino-6-[2-(methylamino)ethoxy]phenol?
The canonical SMILES for 2-amino-6-[2-(methylamino)ethoxy]phenol is CNCCOc1cccc(N)c1O.
What is the InChIKey of 2-amino-6-[2-(methylamino)ethoxy]phenol?
The InChIKey is YSBHFYZQHWZJSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O2/c1-11-5-6-13-8-4-2-3-7(10)9(8)12/h2-4,11-12H,5-6,10H2,1H3.
What are the key properties of 2-amino-6-[2-(methylamino)ethoxy]phenol?
2-amino-6-[2-(methylamino)ethoxy]phenol has a molecular weight of 182.22 g/mol, XLogP of 0.57, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-[2-(methylamino)ethoxy]phenol is sourced from PubChem (CID 58657538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).