6-amino-2-methyl-3-phenylphenol

C13H13NO — CID 175328726

IUPAC6-amino-2-methyl-3-phenylphenol
SMILESCc1c(-c2ccccc2)ccc(N)c1O
InChIInChI=1S/C13H13NO/c1-9-11(7-8-12(14)13(9)15)10-5-3-2-4-6-10/h2-8,15H,14H2,1H3
InChIKeyUHPZUMNVTCABOC-UHFFFAOYSA-N
MW199.25 g/mol
LogP2.95
Rot. Bonds1

About 6-amino-2-methyl-3-phenylphenol

6-amino-2-methyl-3-phenylphenol (PubChem CID 175328726) has the molecular formula C13H13NO and a molecular weight of 199.25 g/mol. Its IUPAC name is 6-amino-2-methyl-3-phenylphenol.

Molecular Properties

Compound Name6-amino-2-methyl-3-phenylphenol
PubChem CID175328726
Molecular FormulaC13H13NO
Molecular Weight199.25 g/mol
Exact Mass199.10
IUPAC Name6-amino-2-methyl-3-phenylphenol
SMILESCc1c(-c2ccccc2)ccc(N)c1O
InChIInChI=1S/C13H13NO/c1-9-11(7-8-12(14)13(9)15)10-5-3-2-4-6-10/h2-8,15H,14H2,1H3
InChIKeyUHPZUMNVTCABOC-UHFFFAOYSA-N
XLogP2.95
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.25
LogP ≤ 52.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-methyl-3-phenylaniline
CID 10511683
2,3-dimethyl-4-phenylphenol
CID 57091246
(2-hydroxy-3-methyl-4-phenylphenyl)methyl acetate
CID 16751644
1-[4-(3,4-diamino-2-methylphenyl)phenyl]-2-phenylethane-1,2-dione
CID 130434169
2-methyl-4-phenyl-3-(1-phenylethyl)aniline
CID 155254910
2-hydroxy-3-methyl-4-(2-phenylphenyl)benzoic acid
CID 19102967
3-methyl-6-phenylbenzene-1,2-diol;bis(3-phenylbenzene-1,2-diol)
CID 67932172
4-methyl-5-phenylbenzene-1,3-diamine
CID 19849980
2-fluoro-6-methyl-3-phenylphenol
CID 66800848
2,3-dimethyl-4,6-diphenylaniline
CID 139240980
2-methyl-6-phenylphenol
CID 12592481
2,6-dimethyl-3-phenylbenzamide;hydrochloride
CID 175606974

Frequently Asked Questions

What is the IUPAC name of 6-amino-2-methyl-3-phenylphenol?
The IUPAC name of 6-amino-2-methyl-3-phenylphenol (CID 175328726) is 6-amino-2-methyl-3-phenylphenol.
What is the SMILES notation for 6-amino-2-methyl-3-phenylphenol?
The canonical SMILES for 6-amino-2-methyl-3-phenylphenol is Cc1c(-c2ccccc2)ccc(N)c1O.
What is the InChIKey of 6-amino-2-methyl-3-phenylphenol?
The InChIKey is UHPZUMNVTCABOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13NO/c1-9-11(7-8-12(14)13(9)15)10-5-3-2-4-6-10/h2-8,15H,14H2,1H3.
What are the key properties of 6-amino-2-methyl-3-phenylphenol?
6-amino-2-methyl-3-phenylphenol has a molecular weight of 199.25 g/mol, XLogP of 2.95, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-2-methyl-3-phenylphenol is sourced from PubChem (CID 175328726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).