3-amino-3,4-dihydro-1H-quinolin-2-one;hydroiodide

C9H11IN2O — CID 17234022

IUPAC3-amino-3,4-dihydro-1H-quinolin-2-one;hydroiodide
SMILESI.NC1Cc2ccccc2NC1=O
InChIInChI=1S/C9H10N2O.HI/c10-7-5-6-3-1-2-4-8(6)11-9(7)12;/h1-4,7H,5,10H2,(H,11,12);1H
InChIKeyRFYXFDXHRUPCCY-UHFFFAOYSA-N
MW290.10 g/mol
LogP1.13
Rot. Bonds

About 3-amino-3,4-dihydro-1H-quinolin-2-one;hydroiodide

3-amino-3,4-dihydro-1H-quinolin-2-one;hydroiodide (PubChem CID 17234022) has the molecular formula C9H11IN2O and a molecular weight of 290.10 g/mol. Its IUPAC name is 3-amino-3,4-dihydro-1H-quinolin-2-one;hydroiodide.

Molecular Properties

Compound Name3-amino-3,4-dihydro-1H-quinolin-2-one;hydroiodide
PubChem CID17234022
Molecular FormulaC9H11IN2O
Molecular Weight290.10 g/mol
Exact Mass289.99
IUPAC Name3-amino-3,4-dihydro-1H-quinolin-2-one;hydroiodide
SMILESI.NC1Cc2ccccc2NC1=O
InChIInChI=1S/C9H10N2O.HI/c10-7-5-6-3-1-2-4-8(6)11-9(7)12;/h1-4,7H,5,10H2,(H,11,12);1H
InChIKeyRFYXFDXHRUPCCY-UHFFFAOYSA-N
XLogP1.13
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.10
LogP ≤ 51.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-amino-3,4-dihydro-1H-quinolin-2-one;hydroiodide?
The IUPAC name of 3-amino-3,4-dihydro-1H-quinolin-2-one;hydroiodide (CID 17234022) is 3-amino-3,4-dihydro-1H-quinolin-2-one;hydroiodide.
What is the SMILES notation for 3-amino-3,4-dihydro-1H-quinolin-2-one;hydroiodide?
The canonical SMILES for 3-amino-3,4-dihydro-1H-quinolin-2-one;hydroiodide is I.NC1Cc2ccccc2NC1=O.
What is the InChIKey of 3-amino-3,4-dihydro-1H-quinolin-2-one;hydroiodide?
The InChIKey is RFYXFDXHRUPCCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2O.HI/c10-7-5-6-3-1-2-4-8(6)11-9(7)12;/h1-4,7H,5,10H2,(H,11,12);1H.
What are the key properties of 3-amino-3,4-dihydro-1H-quinolin-2-one;hydroiodide?
3-amino-3,4-dihydro-1H-quinolin-2-one;hydroiodide has a molecular weight of 290.10 g/mol, XLogP of 1.13, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-3,4-dihydro-1H-quinolin-2-one;hydroiodide is sourced from PubChem (CID 17234022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).