4-[(2-amino-6-methylphenyl)methoxy]-3-methylphenol

C15H17NO2 — CID 129110100

IUPAC4-[(2-amino-6-methylphenyl)methoxy]-3-methylphenol
SMILESCc1cc(O)ccc1OCc1c(C)cccc1N
InChIInChI=1S/C15H17NO2/c1-10-4-3-5-14(16)13(10)9-18-15-7-6-12(17)8-11(15)2/h3-8,17H,9,16H2,1-2H3
InChIKeySGPPSUWICMSPLH-UHFFFAOYSA-N
MW243.31 g/mol
LogP3.17
Rot. Bonds3

About 4-[(2-amino-6-methylphenyl)methoxy]-3-methylphenol

4-[(2-amino-6-methylphenyl)methoxy]-3-methylphenol (PubChem CID 129110100) has the molecular formula C15H17NO2 and a molecular weight of 243.31 g/mol. Its IUPAC name is 4-[(2-amino-6-methylphenyl)methoxy]-3-methylphenol.

Molecular Properties

Compound Name4-[(2-amino-6-methylphenyl)methoxy]-3-methylphenol
PubChem CID129110100
Molecular FormulaC15H17NO2
Molecular Weight243.31 g/mol
Exact Mass243.13
IUPAC Name4-[(2-amino-6-methylphenyl)methoxy]-3-methylphenol
SMILESCc1cc(O)ccc1OCc1c(C)cccc1N
InChIInChI=1S/C15H17NO2/c1-10-4-3-5-14(16)13(10)9-18-15-7-6-12(17)8-11(15)2/h3-8,17H,9,16H2,1-2H3
InChIKeySGPPSUWICMSPLH-UHFFFAOYSA-N
XLogP3.17
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 53.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-[(2-amino-6-methylphenyl)methoxy]-3-chlorophenol
CID 129110246
4-[(2-amino-6-methoxyphenyl)methoxy]-3-methylphenol
CID 129110059
3-methyl-4-[[2-methyl-6-(methylamino)phenyl]methoxy]phenol
CID 129110182
formohydrazide;3-methyl-4-[[2-methyl-6-(methylamino)phenyl]methoxy]phenol
CID 144784892
N-chloro-2-[(4-hydroxy-2-methylphenoxy)methyl]-3-methylbenzamide
CID 129110227
2-[(2,4-dimethylphenoxy)methyl]-3-ethylaniline
CID 118244149
4-[[2-[amino(methyl)amino]-6-fluorophenyl]methoxy]-3-methylphenol
CID 129110158
[3-bromo-2-[(4-hydroxy-2-methylphenoxy)methyl]phenyl] cyanate
CID 129110258
4-[2-[(4-hydroxy-2-methylphenoxy)methyl]-3-methylphenyl]-1H-tetrazol-5-one
CID 137255181
[3-chloro-2-[(4-hydroxy-2-methylphenoxy)methyl]phenyl] cyanate
CID 129110214
2-[(2,4-dimethylphenoxy)methyl]-3-methylbenzamide
CID 118244198
3-bromo-2-[(5-chloro-2,4-dimethylphenoxy)methyl]aniline
CID 121367437

Frequently Asked Questions

What is the IUPAC name of 4-[(2-amino-6-methylphenyl)methoxy]-3-methylphenol?
The IUPAC name of 4-[(2-amino-6-methylphenyl)methoxy]-3-methylphenol (CID 129110100) is 4-[(2-amino-6-methylphenyl)methoxy]-3-methylphenol.
What is the SMILES notation for 4-[(2-amino-6-methylphenyl)methoxy]-3-methylphenol?
The canonical SMILES for 4-[(2-amino-6-methylphenyl)methoxy]-3-methylphenol is Cc1cc(O)ccc1OCc1c(C)cccc1N.
What is the InChIKey of 4-[(2-amino-6-methylphenyl)methoxy]-3-methylphenol?
The InChIKey is SGPPSUWICMSPLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO2/c1-10-4-3-5-14(16)13(10)9-18-15-7-6-12(17)8-11(15)2/h3-8,17H,9,16H2,1-2H3.
What are the key properties of 4-[(2-amino-6-methylphenyl)methoxy]-3-methylphenol?
4-[(2-amino-6-methylphenyl)methoxy]-3-methylphenol has a molecular weight of 243.31 g/mol, XLogP of 3.17, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-amino-6-methylphenyl)methoxy]-3-methylphenol is sourced from PubChem (CID 129110100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).