2-(methylamino)-4-nitrosophenol

C7H8N2O2 — CID 10130054

IUPAC2-(methylamino)-4-nitrosophenol
SMILESCNc1cc(N=O)ccc1O
InChIInChI=1S/C7H8N2O2/c1-8-6-4-5(9-11)2-3-7(6)10/h2-4,8,10H,1H3
InChIKeyGSKJJAGGVMROSZ-UHFFFAOYSA-N
MW152.15 g/mol
LogP1.83
Rot. Bonds2

About 2-(methylamino)-4-nitrosophenol

2-(methylamino)-4-nitrosophenol (PubChem CID 10130054) has the molecular formula C7H8N2O2 and a molecular weight of 152.15 g/mol. Its IUPAC name is 2-(methylamino)-4-nitrosophenol.

Molecular Properties

Compound Name2-(methylamino)-4-nitrosophenol
PubChem CID10130054
Molecular FormulaC7H8N2O2
Molecular Weight152.15 g/mol
Exact Mass152.06
IUPAC Name2-(methylamino)-4-nitrosophenol
SMILESCNc1cc(N=O)ccc1O
InChIInChI=1S/C7H8N2O2/c1-8-6-4-5(9-11)2-3-7(6)10/h2-4,8,10H,1H3
InChIKeyGSKJJAGGVMROSZ-UHFFFAOYSA-N
XLogP1.83
TPSA61.69 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.15
LogP ≤ 51.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-4-nitrosophenol?
The IUPAC name of 2-(methylamino)-4-nitrosophenol (CID 10130054) is 2-(methylamino)-4-nitrosophenol.
What is the SMILES notation for 2-(methylamino)-4-nitrosophenol?
The canonical SMILES for 2-(methylamino)-4-nitrosophenol is CNc1cc(N=O)ccc1O.
What is the InChIKey of 2-(methylamino)-4-nitrosophenol?
The InChIKey is GSKJJAGGVMROSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N2O2/c1-8-6-4-5(9-11)2-3-7(6)10/h2-4,8,10H,1H3.
What are the key properties of 2-(methylamino)-4-nitrosophenol?
2-(methylamino)-4-nitrosophenol has a molecular weight of 152.15 g/mol, XLogP of 1.83, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-4-nitrosophenol is sourced from PubChem (CID 10130054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).