(2-hydroxy-4-methylphenyl)azanium

C7H10NO+ — CID 147753183

IUPAC(2-hydroxy-4-methylphenyl)azanium
SMILESCc1ccc([NH3+])c(O)c1
InChIInChI=1S/C7H9NO/c1-5-2-3-6(8)7(9)4-5/h2-4,9H,8H2,1H3/p+1
InChIKeyHCPJEHJGFKWRFM-UHFFFAOYSA-O
MW124.16 g/mol
LogP0.57
Rot. Bonds

About (2-hydroxy-4-methylphenyl)azanium

(2-hydroxy-4-methylphenyl)azanium (PubChem CID 147753183) has the molecular formula C7H10NO+ and a molecular weight of 124.16 g/mol. Its IUPAC name is (2-hydroxy-4-methylphenyl)azanium.

Molecular Properties

Compound Name(2-hydroxy-4-methylphenyl)azanium
PubChem CID147753183
Molecular FormulaC7H10NO+
Molecular Weight124.16 g/mol
Exact Mass124.08
IUPAC Name(2-hydroxy-4-methylphenyl)azanium
SMILESCc1ccc([NH3+])c(O)c1
InChIInChI=1S/C7H9NO/c1-5-2-3-6(8)7(9)4-5/h2-4,9H,8H2,1H3/p+1
InChIKeyHCPJEHJGFKWRFM-UHFFFAOYSA-O
XLogP0.57
TPSA47.87 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.16
LogP ≤ 50.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

bis(4-methylbenzene-1,2-diol);zirconium
CID 23558294
2,5-dimethylphenol;samarium
CID 87732062
2,5-dimethylphenol;ethane
CID 143419778
bis(2,5-dimethylphenol);dihydrochloride
CID 70596946
(2-hydroxy-4-methylphenyl)mercury(1+)
CID 86278218
2,4-dimethylphenol
CID 67713801
(2-hydroxy-4-methylphenyl)-dimethylsulfanium
CID 161182706
2,5-dimethylphenol;4-methylphenol
CID 67649093
2,4-dimethylphenol;yttrium
CID 87733318
CID 172763014
CID 172763014
CID 175892141
CID 175892141
cobalt;bis(5-methyl-2-propan-2-ylphenol)
CID 156896903

Frequently Asked Questions

What is the IUPAC name of (2-hydroxy-4-methylphenyl)azanium?
The IUPAC name of (2-hydroxy-4-methylphenyl)azanium (CID 147753183) is (2-hydroxy-4-methylphenyl)azanium.
What is the SMILES notation for (2-hydroxy-4-methylphenyl)azanium?
The canonical SMILES for (2-hydroxy-4-methylphenyl)azanium is Cc1ccc([NH3+])c(O)c1.
What is the InChIKey of (2-hydroxy-4-methylphenyl)azanium?
The InChIKey is HCPJEHJGFKWRFM-UHFFFAOYSA-O. The full InChI is InChI=1S/C7H9NO/c1-5-2-3-6(8)7(9)4-5/h2-4,9H,8H2,1H3/p+1.
What are the key properties of (2-hydroxy-4-methylphenyl)azanium?
(2-hydroxy-4-methylphenyl)azanium has a molecular weight of 124.16 g/mol, XLogP of 0.57, 0 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-hydroxy-4-methylphenyl)azanium is sourced from PubChem (CID 147753183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).