carbamoperoxoic acid;quinolin-8-ol

C10H10N2O4 — CID 175492056

IUPACcarbamoperoxoic acid;quinolin-8-ol
SMILESNC(=O)OO.Oc1cccc2cccnc12
InChIInChI=1S/C9H7NO.CH3NO3/c11-8-5-1-3-7-4-2-6-10-9(7)8;2-1(3)5-4/h1-6,11H;4H,(H2,2,3)
InChIKeyUOAZZEGEBNWHLS-UHFFFAOYSA-N
MW222.20 g/mol
LogP1.50
Rot. Bonds

About carbamoperoxoic acid;quinolin-8-ol

carbamoperoxoic acid;quinolin-8-ol (PubChem CID 175492056) has the molecular formula C10H10N2O4 and a molecular weight of 222.20 g/mol. Its IUPAC name is carbamoperoxoic acid;quinolin-8-ol.

Molecular Properties

Compound Namecarbamoperoxoic acid;quinolin-8-ol
PubChem CID175492056
Molecular FormulaC10H10N2O4
Molecular Weight222.20 g/mol
Exact Mass222.06
IUPAC Namecarbamoperoxoic acid;quinolin-8-ol
SMILESNC(=O)OO.Oc1cccc2cccnc12
InChIInChI=1S/C9H7NO.CH3NO3/c11-8-5-1-3-7-4-2-6-10-9(7)8;2-1(3)5-4/h1-6,11H;4H,(H2,2,3)
InChIKeyUOAZZEGEBNWHLS-UHFFFAOYSA-N
XLogP1.50
TPSA105.67 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.20
LogP ≤ 51.50
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}

Analyze carbamoperoxoic acid;quinolin-8-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

CID 54604144
CID 54604144
quinolin-8-ol;yttrium
CID 174635627
oxozinc;quinolin-8-ol
CID 174943156
CID 70016201
CID 70016201
zinc quinolin-8-ol
CID 22057723
CID 87330016
CID 87330016
CID 6381061
CID 6381061
dipotassium;quinolin-8-ol;carbonate
CID 174968438
CID 174914731
CID 174914731
methanol;quinolin-8-ol
CID 161490698
acetic acid;bis(palladium);bis(quinolin-8-ol)
CID 171726767
cobalt;methanediamine;bis(quinolin-8-ol)
CID 87691611

Frequently Asked Questions

What is the IUPAC name of carbamoperoxoic acid;quinolin-8-ol?
The IUPAC name of carbamoperoxoic acid;quinolin-8-ol (CID 175492056) is carbamoperoxoic acid;quinolin-8-ol.
What is the SMILES notation for carbamoperoxoic acid;quinolin-8-ol?
The canonical SMILES for carbamoperoxoic acid;quinolin-8-ol is NC(=O)OO.Oc1cccc2cccnc12.
What is the InChIKey of carbamoperoxoic acid;quinolin-8-ol?
The InChIKey is UOAZZEGEBNWHLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7NO.CH3NO3/c11-8-5-1-3-7-4-2-6-10-9(7)8;2-1(3)5-4/h1-6,11H;4H,(H2,2,3).
What are the key properties of carbamoperoxoic acid;quinolin-8-ol?
carbamoperoxoic acid;quinolin-8-ol has a molecular weight of 222.20 g/mol, XLogP of 1.50, 0 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for carbamoperoxoic acid;quinolin-8-ol is sourced from PubChem (CID 175492056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).