8-fluoro-3-iodo-6-methyl-1H-quinolin-4-one

C10H7FINO — CID 102614971

IUPAC8-fluoro-3-iodo-6-methyl-1H-quinolin-4-one
SMILESCc1cc(F)c2[nH]cc(I)c(=O)c2c1
InChIInChI=1S/C10H7FINO/c1-5-2-6-9(7(11)3-5)13-4-8(12)10(6)14/h2-4H,1H3,(H,13,14)
InChIKeyZXGXIXSQCVRTNP-UHFFFAOYSA-N
MW303.07 g/mol
LogP2.58
Rot. Bonds

About 8-fluoro-3-iodo-6-methyl-1H-quinolin-4-one

8-fluoro-3-iodo-6-methyl-1H-quinolin-4-one (PubChem CID 102614971) has the molecular formula C10H7FINO and a molecular weight of 303.07 g/mol. Its IUPAC name is 8-fluoro-3-iodo-6-methyl-1H-quinolin-4-one.

Molecular Properties

Compound Name8-fluoro-3-iodo-6-methyl-1H-quinolin-4-one
PubChem CID102614971
Molecular FormulaC10H7FINO
Molecular Weight303.07 g/mol
Exact Mass302.96
IUPAC Name8-fluoro-3-iodo-6-methyl-1H-quinolin-4-one
SMILESCc1cc(F)c2[nH]cc(I)c(=O)c2c1
InChIInChI=1S/C10H7FINO/c1-5-2-6-9(7(11)3-5)13-4-8(12)10(6)14/h2-4H,1H3,(H,13,14)
InChIKeyZXGXIXSQCVRTNP-UHFFFAOYSA-N
XLogP2.58
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.07
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 8-fluoro-3-iodo-6-methyl-1H-quinolin-4-one?
The IUPAC name of 8-fluoro-3-iodo-6-methyl-1H-quinolin-4-one (CID 102614971) is 8-fluoro-3-iodo-6-methyl-1H-quinolin-4-one.
What is the SMILES notation for 8-fluoro-3-iodo-6-methyl-1H-quinolin-4-one?
The canonical SMILES for 8-fluoro-3-iodo-6-methyl-1H-quinolin-4-one is Cc1cc(F)c2[nH]cc(I)c(=O)c2c1.
What is the InChIKey of 8-fluoro-3-iodo-6-methyl-1H-quinolin-4-one?
The InChIKey is ZXGXIXSQCVRTNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7FINO/c1-5-2-6-9(7(11)3-5)13-4-8(12)10(6)14/h2-4H,1H3,(H,13,14).
What are the key properties of 8-fluoro-3-iodo-6-methyl-1H-quinolin-4-one?
8-fluoro-3-iodo-6-methyl-1H-quinolin-4-one has a molecular weight of 303.07 g/mol, XLogP of 2.58, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-fluoro-3-iodo-6-methyl-1H-quinolin-4-one is sourced from PubChem (CID 102614971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).