5-(7-fluoro-1-benzofuran-2-yl)-3-methylpyridin-2-amine

C14H11FN2O — CID 114731979

IUPAC5-(7-fluoro-1-benzofuran-2-yl)-3-methylpyridin-2-amine
SMILESCc1cc(-c2cc3cccc(F)c3o2)cnc1N
InChIInChI=1S/C14H11FN2O/c1-8-5-10(7-17-14(8)16)12-6-9-3-2-4-11(15)13(9)18-12/h2-7H,1H3,(H2,16,17)
InChIKeyKICIINJMFUALGJ-UHFFFAOYSA-N
MW242.25 g/mol
LogP3.52
Rot. Bonds1

About 5-(7-fluoro-1-benzofuran-2-yl)-3-methylpyridin-2-amine

5-(7-fluoro-1-benzofuran-2-yl)-3-methylpyridin-2-amine (PubChem CID 114731979) has the molecular formula C14H11FN2O and a molecular weight of 242.25 g/mol. Its IUPAC name is 5-(7-fluoro-1-benzofuran-2-yl)-3-methylpyridin-2-amine.

Molecular Properties

Compound Name5-(7-fluoro-1-benzofuran-2-yl)-3-methylpyridin-2-amine
PubChem CID114731979
Molecular FormulaC14H11FN2O
Molecular Weight242.25 g/mol
Exact Mass242.09
IUPAC Name5-(7-fluoro-1-benzofuran-2-yl)-3-methylpyridin-2-amine
SMILESCc1cc(-c2cc3cccc(F)c3o2)cnc1N
InChIInChI=1S/C14H11FN2O/c1-8-5-10(7-17-14(8)16)12-6-9-3-2-4-11(15)13(9)18-12/h2-7H,1H3,(H2,16,17)
InChIKeyKICIINJMFUALGJ-UHFFFAOYSA-N
XLogP3.52
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.25
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-(7-fluoro-1-benzofuran-2-yl)-4,5-dimethylpyridazin-3-amine
CID 114734957
[4-(7-fluoro-1-benzofuran-2-yl)phenyl]methanamine
CID 114731985
5-(7-fluoro-1-benzofuran-2-yl)-1H-indazole
CID 166359737
5-(2,5-difluorophenyl)-3-methylpyridin-2-amine
CID 83170402
5-(4-fluoronaphthalen-1-yl)-3-methylpyridin-2-amine
CID 83170406
2-ethyl-6-(7-fluoro-1-benzofuran-2-yl)pyrimidin-4-amine
CID 114734954
4-bromo-6-(7-fluoro-1-benzofuran-2-yl)-2-methylpyrimidine
CID 114734322
3-methyl-5-(3-methylphenyl)pyridin-2-amine
CID 80505501
1-[3-(7-fluoro-1-benzofuran-2-yl)phenyl]-N-methylmethanamine
CID 114731957
(7-fluoro-1-benzofuran-2-yl)-trimethylsilane
CID 130535912
5-(2,5-difluoro-4-methylphenyl)-3-methylpyridin-2-amine
CID 83170014
[2-(7-fluoro-1-benzofuran-2-yl)-4-pyridinyl]methanamine
CID 115113748

Frequently Asked Questions

What is the IUPAC name of 5-(7-fluoro-1-benzofuran-2-yl)-3-methylpyridin-2-amine?
The IUPAC name of 5-(7-fluoro-1-benzofuran-2-yl)-3-methylpyridin-2-amine (CID 114731979) is 5-(7-fluoro-1-benzofuran-2-yl)-3-methylpyridin-2-amine.
What is the SMILES notation for 5-(7-fluoro-1-benzofuran-2-yl)-3-methylpyridin-2-amine?
The canonical SMILES for 5-(7-fluoro-1-benzofuran-2-yl)-3-methylpyridin-2-amine is Cc1cc(-c2cc3cccc(F)c3o2)cnc1N.
What is the InChIKey of 5-(7-fluoro-1-benzofuran-2-yl)-3-methylpyridin-2-amine?
The InChIKey is KICIINJMFUALGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11FN2O/c1-8-5-10(7-17-14(8)16)12-6-9-3-2-4-11(15)13(9)18-12/h2-7H,1H3,(H2,16,17).
What are the key properties of 5-(7-fluoro-1-benzofuran-2-yl)-3-methylpyridin-2-amine?
5-(7-fluoro-1-benzofuran-2-yl)-3-methylpyridin-2-amine has a molecular weight of 242.25 g/mol, XLogP of 3.52, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(7-fluoro-1-benzofuran-2-yl)-3-methylpyridin-2-amine is sourced from PubChem (CID 114731979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).