7-iodo-2-methylquinolin-5-ol

C10H8INO — CID 135553020

IUPAC7-iodo-2-methylquinolin-5-ol
SMILESCc1ccc2c(O)cc(I)cc2n1
InChIInChI=1S/C10H8INO/c1-6-2-3-8-9(12-6)4-7(11)5-10(8)13/h2-5,13H,1H3
InChIKeyJVSPQOPJPXGZQJ-UHFFFAOYSA-N
MW285.08 g/mol
LogP2.85
Rot. Bonds

About 7-iodo-2-methylquinolin-5-ol

7-iodo-2-methylquinolin-5-ol (PubChem CID 135553020) has the molecular formula C10H8INO and a molecular weight of 285.08 g/mol. Its IUPAC name is 7-iodo-2-methylquinolin-5-ol.

Molecular Properties

Compound Name7-iodo-2-methylquinolin-5-ol
PubChem CID135553020
Molecular FormulaC10H8INO
Molecular Weight285.08 g/mol
Exact Mass284.97
IUPAC Name7-iodo-2-methylquinolin-5-ol
SMILESCc1ccc2c(O)cc(I)cc2n1
InChIInChI=1S/C10H8INO/c1-6-2-3-8-9(12-6)4-7(11)5-10(8)13/h2-5,13H,1H3
InChIKeyJVSPQOPJPXGZQJ-UHFFFAOYSA-N
XLogP2.85
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.08
LogP ≤ 52.85
H-Bond Donors ≤ 51
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 7-iodo-2-methylquinolin-5-ol?
The IUPAC name of 7-iodo-2-methylquinolin-5-ol (CID 135553020) is 7-iodo-2-methylquinolin-5-ol.
What is the SMILES notation for 7-iodo-2-methylquinolin-5-ol?
The canonical SMILES for 7-iodo-2-methylquinolin-5-ol is Cc1ccc2c(O)cc(I)cc2n1.
What is the InChIKey of 7-iodo-2-methylquinolin-5-ol?
The InChIKey is JVSPQOPJPXGZQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8INO/c1-6-2-3-8-9(12-6)4-7(11)5-10(8)13/h2-5,13H,1H3.
What are the key properties of 7-iodo-2-methylquinolin-5-ol?
7-iodo-2-methylquinolin-5-ol has a molecular weight of 285.08 g/mol, XLogP of 2.85, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-iodo-2-methylquinolin-5-ol is sourced from PubChem (CID 135553020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).