5-[(3-hydroxyphenyl)methylamino]-2-methylphenol

C14H15NO2 — CID 22983329

IUPAC5-[(3-hydroxyphenyl)methylamino]-2-methylphenol
SMILESCc1ccc(NCc2cccc(O)c2)cc1O
InChIInChI=1S/C14H15NO2/c1-10-5-6-12(8-14(10)17)15-9-11-3-2-4-13(16)7-11/h2-8,15-17H,9H2,1H3
InChIKeyXMAFYZSDYJEKPO-UHFFFAOYSA-N
MW229.28 g/mol
LogP3.02
Rot. Bonds3

About 5-[(3-hydroxyphenyl)methylamino]-2-methylphenol

5-[(3-hydroxyphenyl)methylamino]-2-methylphenol (PubChem CID 22983329) has the molecular formula C14H15NO2 and a molecular weight of 229.28 g/mol. Its IUPAC name is 5-[(3-hydroxyphenyl)methylamino]-2-methylphenol.

Molecular Properties

Compound Name5-[(3-hydroxyphenyl)methylamino]-2-methylphenol
PubChem CID22983329
Molecular FormulaC14H15NO2
Molecular Weight229.28 g/mol
Exact Mass229.11
IUPAC Name5-[(3-hydroxyphenyl)methylamino]-2-methylphenol
SMILESCc1ccc(NCc2cccc(O)c2)cc1O
InChIInChI=1S/C14H15NO2/c1-10-5-6-12(8-14(10)17)15-9-11-3-2-4-13(16)7-11/h2-8,15-17H,9H2,1H3
InChIKeyXMAFYZSDYJEKPO-UHFFFAOYSA-N
XLogP3.02
TPSA52.49 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 53.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

5-[(3-chlorophenyl)methylamino]-2-methylphenol
CID 18615765
3-[(3-hydroxyanilino)methyl]phenol
CID 21321439
3-[(naphthalen-2-ylamino)methyl]phenol
CID 43680286
3-[[(2-methyl-1,3-benzothiazol-6-yl)amino]methyl]phenol
CID 43682648
2,6-dibromo-4-[(3-hydroxy-4-methylanilino)methyl]phenol
CID 107741199
4-[(3-hydroxy-4-methylanilino)methyl]-2,6-dimethoxyphenol
CID 107700768
3-[(3-fluoro-4-methoxyanilino)methyl]phenol
CID 43380515
3-[(4-ethylsulfonylanilino)methyl]phenol
CID 43689674
N-[3-[(3-hydroxyphenyl)methylamino]phenyl]methanesulfonamide
CID 28731454
2-(hydroxymethyl)-5-[(3-methylphenyl)methylamino]phenol
CID 83962331
N-[2-chloro-4-[(3-hydroxyphenyl)methylamino]phenyl]acetamide
CID 43690205
N-[4-[(3-hydroxyphenyl)methylamino]phenyl]-2-methylpropanamide
CID 43683747

Frequently Asked Questions

What is the IUPAC name of 5-[(3-hydroxyphenyl)methylamino]-2-methylphenol?
The IUPAC name of 5-[(3-hydroxyphenyl)methylamino]-2-methylphenol (CID 22983329) is 5-[(3-hydroxyphenyl)methylamino]-2-methylphenol.
What is the SMILES notation for 5-[(3-hydroxyphenyl)methylamino]-2-methylphenol?
The canonical SMILES for 5-[(3-hydroxyphenyl)methylamino]-2-methylphenol is Cc1ccc(NCc2cccc(O)c2)cc1O.
What is the InChIKey of 5-[(3-hydroxyphenyl)methylamino]-2-methylphenol?
The InChIKey is XMAFYZSDYJEKPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO2/c1-10-5-6-12(8-14(10)17)15-9-11-3-2-4-13(16)7-11/h2-8,15-17H,9H2,1H3.
What are the key properties of 5-[(3-hydroxyphenyl)methylamino]-2-methylphenol?
5-[(3-hydroxyphenyl)methylamino]-2-methylphenol has a molecular weight of 229.28 g/mol, XLogP of 3.02, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(3-hydroxyphenyl)methylamino]-2-methylphenol is sourced from PubChem (CID 22983329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).