3-fluoro-7-methyl-8-pyridin-2-yldibenzofuran-4-carbonitrile

C19H11FN2O — CID 170250753

IUPAC3-fluoro-7-methyl-8-pyridin-2-yldibenzofuran-4-carbonitrile
SMILESCc1cc2oc3c(C#N)c(F)ccc3c2cc1-c1ccccn1
InChIInChI=1S/C19H11FN2O/c1-11-8-18-14(9-13(11)17-4-2-3-7-22-17)12-5-6-16(20)15(10-21)19(12)23-18/h2-9H,1H3
InChIKeyDFDDULIPFMJGRV-UHFFFAOYSA-N
MW302.31 g/mol
LogP4.97
Rot. Bonds1

About 3-fluoro-7-methyl-8-pyridin-2-yldibenzofuran-4-carbonitrile

3-fluoro-7-methyl-8-pyridin-2-yldibenzofuran-4-carbonitrile (PubChem CID 170250753) has the molecular formula C19H11FN2O and a molecular weight of 302.31 g/mol. Its IUPAC name is 3-fluoro-7-methyl-8-pyridin-2-yldibenzofuran-4-carbonitrile.

Molecular Properties

Compound Name3-fluoro-7-methyl-8-pyridin-2-yldibenzofuran-4-carbonitrile
PubChem CID170250753
Molecular FormulaC19H11FN2O
Molecular Weight302.31 g/mol
Exact Mass302.09
IUPAC Name3-fluoro-7-methyl-8-pyridin-2-yldibenzofuran-4-carbonitrile
SMILESCc1cc2oc3c(C#N)c(F)ccc3c2cc1-c1ccccn1
InChIInChI=1S/C19H11FN2O/c1-11-8-18-14(9-13(11)17-4-2-3-7-22-17)12-5-6-16(20)15(10-21)19(12)23-18/h2-9H,1H3
InChIKeyDFDDULIPFMJGRV-UHFFFAOYSA-N
XLogP4.97
TPSA49.82 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.31
LogP ≤ 54.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4,5-difluoro-2-methylphenyl)pyridine;ethane
CID 145481986
2-(2,5-dimethyl-4-pyridin-2-ylphenyl)pyridine
CID 118652406
1-fluoro-6-pyridin-2-yldibenzofuran-3-carbonitrile
CID 170250799
4-fluoro-7-methyl-8-(1-methylpyridin-1-ium-2-yl)dibenzofuran-3-carbonitrile
CID 170250705
6-methyl-4-pyridin-2-ylpyridine-3-carbonitrile
CID 82112135
2-(2-methyl-[1]benzothiolo[3,2-b][1]benzofuran-1-yl)pyridine
CID 170112879
8-methyl-6-pyridin-2-yldibenzofuran-4-carbonitrile
CID 170251109
2-(7-fluoro-3,6-dimethyldibenzofuran-2-yl)-1-methylpyridin-1-ium
CID 160680313
2-(2,5-difluoro-4-methylphenyl)pyridine
CID 170974832
2-(5-fluoro-4-isocyano-2-methylphenyl)pyridine
CID 153319439
2-[7-fluoro-6-[4-(4-phenylphenyl)phenyl]dibenzofuran-4-yl]pyridine
CID 165385994
2-(3-methyldibenzofuran-4-yl)pyridine
CID 118074682

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-7-methyl-8-pyridin-2-yldibenzofuran-4-carbonitrile?
The IUPAC name of 3-fluoro-7-methyl-8-pyridin-2-yldibenzofuran-4-carbonitrile (CID 170250753) is 3-fluoro-7-methyl-8-pyridin-2-yldibenzofuran-4-carbonitrile.
What is the SMILES notation for 3-fluoro-7-methyl-8-pyridin-2-yldibenzofuran-4-carbonitrile?
The canonical SMILES for 3-fluoro-7-methyl-8-pyridin-2-yldibenzofuran-4-carbonitrile is Cc1cc2oc3c(C#N)c(F)ccc3c2cc1-c1ccccn1.
What is the InChIKey of 3-fluoro-7-methyl-8-pyridin-2-yldibenzofuran-4-carbonitrile?
The InChIKey is DFDDULIPFMJGRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H11FN2O/c1-11-8-18-14(9-13(11)17-4-2-3-7-22-17)12-5-6-16(20)15(10-21)19(12)23-18/h2-9H,1H3.
What are the key properties of 3-fluoro-7-methyl-8-pyridin-2-yldibenzofuran-4-carbonitrile?
3-fluoro-7-methyl-8-pyridin-2-yldibenzofuran-4-carbonitrile has a molecular weight of 302.31 g/mol, XLogP of 4.97, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-7-methyl-8-pyridin-2-yldibenzofuran-4-carbonitrile is sourced from PubChem (CID 170250753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).