[2-(7-fluoro-1-benzofuran-2-yl)-4-pyridinyl]methanamine

C14H11FN2O — CID 115113748

IUPAC[2-(7-fluoro-1-benzofuran-2-yl)-4-pyridinyl]methanamine
SMILESNCc1ccnc(-c2cc3cccc(F)c3o2)c1
InChIInChI=1S/C14H11FN2O/c15-11-3-1-2-10-7-13(18-14(10)11)12-6-9(8-16)4-5-17-12/h1-7H,8,16H2
InChIKeyJVLZHSVSRVBFBZ-UHFFFAOYSA-N
MW242.25 g/mol
LogP3.09
Rot. Bonds2

About [2-(7-fluoro-1-benzofuran-2-yl)-4-pyridinyl]methanamine

[2-(7-fluoro-1-benzofuran-2-yl)-4-pyridinyl]methanamine (PubChem CID 115113748) has the molecular formula C14H11FN2O and a molecular weight of 242.25 g/mol. Its IUPAC name is [2-(7-fluoro-1-benzofuran-2-yl)-4-pyridinyl]methanamine.

Molecular Properties

Compound Name[2-(7-fluoro-1-benzofuran-2-yl)-4-pyridinyl]methanamine
PubChem CID115113748
Molecular FormulaC14H11FN2O
Molecular Weight242.25 g/mol
Exact Mass242.09
IUPAC Name[2-(7-fluoro-1-benzofuran-2-yl)-4-pyridinyl]methanamine
SMILESNCc1ccnc(-c2cc3cccc(F)c3o2)c1
InChIInChI=1S/C14H11FN2O/c15-11-3-1-2-10-7-13(18-14(10)11)12-6-9(8-16)4-5-17-12/h1-7H,8,16H2
InChIKeyJVLZHSVSRVBFBZ-UHFFFAOYSA-N
XLogP3.09
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.25
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[4-(7-fluoro-1-benzofuran-2-yl)phenyl]methanamine
CID 114731985
2-(7-fluoro-1-benzofuran-2-yl)pyridine-4-carboxylic acid
CID 115113758
2-chloro-6-(7-fluoro-1-benzofuran-2-yl)pyrazine
CID 114734299
6-(7-fluoro-1-benzofuran-2-yl)-N-propylpyrimidin-4-amine
CID 114734949
2-ethyl-6-(7-fluoro-1-benzofuran-2-yl)pyrimidin-4-amine
CID 114734954
[2-(6-methoxy-1-benzofuran-2-yl)-4-pyridinyl]methanamine
CID 115113849
[2-(3-fluorophenyl)-4-pyridinyl]methanamine;dihydrochloride
CID 171365586
[2-(4-fluoro-1-methylindol-3-yl)-4-pyridinyl]methanamine
CID 115114192
2-(7-methyl-1-benzofuran-2-yl)pyridin-4-amine
CID 114731846
[3-(7-chloro-1-benzofuran-2-yl)-4-fluorophenyl]methanamine
CID 114732565
2-[7-(trifluoromethyl)-1-benzofuran-2-yl]pyridin-4-amine
CID 115113737
6-(7-fluoro-1-benzofuran-2-yl)-2-(methoxymethyl)pyrimidin-4-amine
CID 114734919

Frequently Asked Questions

What is the IUPAC name of [2-(7-fluoro-1-benzofuran-2-yl)-4-pyridinyl]methanamine?
The IUPAC name of [2-(7-fluoro-1-benzofuran-2-yl)-4-pyridinyl]methanamine (CID 115113748) is [2-(7-fluoro-1-benzofuran-2-yl)-4-pyridinyl]methanamine.
What is the SMILES notation for [2-(7-fluoro-1-benzofuran-2-yl)-4-pyridinyl]methanamine?
The canonical SMILES for [2-(7-fluoro-1-benzofuran-2-yl)-4-pyridinyl]methanamine is NCc1ccnc(-c2cc3cccc(F)c3o2)c1.
What is the InChIKey of [2-(7-fluoro-1-benzofuran-2-yl)-4-pyridinyl]methanamine?
The InChIKey is JVLZHSVSRVBFBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11FN2O/c15-11-3-1-2-10-7-13(18-14(10)11)12-6-9(8-16)4-5-17-12/h1-7H,8,16H2.
What are the key properties of [2-(7-fluoro-1-benzofuran-2-yl)-4-pyridinyl]methanamine?
[2-(7-fluoro-1-benzofuran-2-yl)-4-pyridinyl]methanamine has a molecular weight of 242.25 g/mol, XLogP of 3.09, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(7-fluoro-1-benzofuran-2-yl)-4-pyridinyl]methanamine is sourced from PubChem (CID 115113748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).