7-fluoro-6-methoxyquinoline-2-carbonitrile

C11H7FN2O — CID 102941351

IUPAC7-fluoro-6-methoxyquinoline-2-carbonitrile
SMILESCOc1cc2ccc(C#N)nc2cc1F
InChIInChI=1S/C11H7FN2O/c1-15-11-4-7-2-3-8(6-13)14-10(7)5-9(11)12/h2-5H,1H3
InChIKeyVIVHTKUQSLILED-UHFFFAOYSA-N
MW202.19 g/mol
LogP2.25
Rot. Bonds1

About 7-fluoro-6-methoxyquinoline-2-carbonitrile

7-fluoro-6-methoxyquinoline-2-carbonitrile (PubChem CID 102941351) has the molecular formula C11H7FN2O and a molecular weight of 202.19 g/mol. Its IUPAC name is 7-fluoro-6-methoxyquinoline-2-carbonitrile.

Molecular Properties

Compound Name7-fluoro-6-methoxyquinoline-2-carbonitrile
PubChem CID102941351
Molecular FormulaC11H7FN2O
Molecular Weight202.19 g/mol
Exact Mass202.05
IUPAC Name7-fluoro-6-methoxyquinoline-2-carbonitrile
SMILESCOc1cc2ccc(C#N)nc2cc1F
InChIInChI=1S/C11H7FN2O/c1-15-11-4-7-2-3-8(6-13)14-10(7)5-9(11)12/h2-5H,1H3
InChIKeyVIVHTKUQSLILED-UHFFFAOYSA-N
XLogP2.25
TPSA45.91 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.19
LogP ≤ 52.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(2-cyano-6-methoxyquinolin-7-yl)boronic acid
CID 125469646
5,6,7-trifluoroquinoline-2-carbonitrile
CID 102941305
6,8-dimethoxy-1,5-naphthyridine-2-carbonitrile
CID 59256522
2-(4-fluoro-3-methoxyanilino)pyrimidine-4-carbonitrile
CID 107545386
5-[ethyl-[(3-fluoro-4-methoxyphenyl)methyl]amino]pyridine-2-carbonitrile
CID 176963272
5-(3-fluoro-4-methoxyphenyl)-1-methylpyrazole-3-carbonitrile
CID 116858619
4-(3-fluoro-4-methoxyanilino)pyridine-2-carbonitrile
CID 62927039
7-fluoro-6-methoxy-4-methylquinoline-3-carbonitrile
CID 59849538
5-methoxy-6-(trifluoromethoxy)pyridine-2-carbonitrile
CID 133096355
7-(trifluoromethyl)quinoline-2-carbonitrile
CID 75355798
6-fluoro-5-methoxy-2-(4-methoxyphenyl)indazole
CID 176556581
CID 10264721
CID 10264721

Frequently Asked Questions

What is the IUPAC name of 7-fluoro-6-methoxyquinoline-2-carbonitrile?
The IUPAC name of 7-fluoro-6-methoxyquinoline-2-carbonitrile (CID 102941351) is 7-fluoro-6-methoxyquinoline-2-carbonitrile.
What is the SMILES notation for 7-fluoro-6-methoxyquinoline-2-carbonitrile?
The canonical SMILES for 7-fluoro-6-methoxyquinoline-2-carbonitrile is COc1cc2ccc(C#N)nc2cc1F.
What is the InChIKey of 7-fluoro-6-methoxyquinoline-2-carbonitrile?
The InChIKey is VIVHTKUQSLILED-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7FN2O/c1-15-11-4-7-2-3-8(6-13)14-10(7)5-9(11)12/h2-5H,1H3.
What are the key properties of 7-fluoro-6-methoxyquinoline-2-carbonitrile?
7-fluoro-6-methoxyquinoline-2-carbonitrile has a molecular weight of 202.19 g/mol, XLogP of 2.25, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-6-methoxyquinoline-2-carbonitrile is sourced from PubChem (CID 102941351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).