[2-(6-methoxy-1-benzofuran-2-yl)-4-pyridinyl]methanamine

C15H14N2O2 — CID 115113849

IUPAC[2-(6-methoxy-1-benzofuran-2-yl)-4-pyridinyl]methanamine
SMILESCOc1ccc2cc(-c3cc(CN)ccn3)oc2c1
InChIInChI=1S/C15H14N2O2/c1-18-12-3-2-11-7-15(19-14(11)8-12)13-6-10(9-16)4-5-17-13/h2-8H,9,16H2,1H3
InChIKeyJDHMOCWEKXJWHF-UHFFFAOYSA-N
MW254.29 g/mol
LogP2.96
Rot. Bonds3

About [2-(6-methoxy-1-benzofuran-2-yl)-4-pyridinyl]methanamine

[2-(6-methoxy-1-benzofuran-2-yl)-4-pyridinyl]methanamine (PubChem CID 115113849) has the molecular formula C15H14N2O2 and a molecular weight of 254.29 g/mol. Its IUPAC name is [2-(6-methoxy-1-benzofuran-2-yl)-4-pyridinyl]methanamine.

Molecular Properties

Compound Name[2-(6-methoxy-1-benzofuran-2-yl)-4-pyridinyl]methanamine
PubChem CID115113849
Molecular FormulaC15H14N2O2
Molecular Weight254.29 g/mol
Exact Mass254.11
IUPAC Name[2-(6-methoxy-1-benzofuran-2-yl)-4-pyridinyl]methanamine
SMILESCOc1ccc2cc(-c3cc(CN)ccn3)oc2c1
InChIInChI=1S/C15H14N2O2/c1-18-12-3-2-11-7-15(19-14(11)8-12)13-6-10(9-16)4-5-17-13/h2-8H,9,16H2,1H3
InChIKeyJDHMOCWEKXJWHF-UHFFFAOYSA-N
XLogP2.96
TPSA61.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.29
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(6-methoxy-1-benzofuran-2-yl)-1,2-oxazol-4-amine
CID 115109592
[2-(6-methoxy-1-methylindol-3-yl)-4-pyridinyl]methanamine
CID 115114129
2-[[2-(1,2-oxazol-3-yl)-1-benzofuran-6-yl]oxy]ethanamine
CID 141070530
1-ethyl-2-(6-methoxy-1-benzofuran-2-yl)imidazole;hydrochloride
CID 3073611
4-(6-methoxy-1-benzofuran-2-yl)-1-methylpyridin-1-ium iodide
CID 23312198
[6-(6-methyl-1-benzofuran-2-yl)-3-pyridinyl]methanamine
CID 115110735
7-methoxy-2-oxochromene-3-carbaldehyde
CID 10420437
4-(6-methoxy-1-benzofuran-2-yl)-1-methylpyridin-1-ium
CID 23312199
2-(6-methoxy-1-benzofuran-2-yl)propan-1-amine
CID 131548433
[3-(7-methoxyisoquinolin-1-yl)phenyl]methanamine
CID 116995305
2-[3-(6-methoxy-1-benzofuran-2-yl)imidazo[1,2-b]pyridazin-6-yl]oxyethanamine
CID 121440007
2-[2,4-bis(phenylmethoxy)phenyl]-6-methoxy-1-benzofuran
CID 141293707

Frequently Asked Questions

What is the IUPAC name of [2-(6-methoxy-1-benzofuran-2-yl)-4-pyridinyl]methanamine?
The IUPAC name of [2-(6-methoxy-1-benzofuran-2-yl)-4-pyridinyl]methanamine (CID 115113849) is [2-(6-methoxy-1-benzofuran-2-yl)-4-pyridinyl]methanamine.
What is the SMILES notation for [2-(6-methoxy-1-benzofuran-2-yl)-4-pyridinyl]methanamine?
The canonical SMILES for [2-(6-methoxy-1-benzofuran-2-yl)-4-pyridinyl]methanamine is COc1ccc2cc(-c3cc(CN)ccn3)oc2c1.
What is the InChIKey of [2-(6-methoxy-1-benzofuran-2-yl)-4-pyridinyl]methanamine?
The InChIKey is JDHMOCWEKXJWHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O2/c1-18-12-3-2-11-7-15(19-14(11)8-12)13-6-10(9-16)4-5-17-13/h2-8H,9,16H2,1H3.
What are the key properties of [2-(6-methoxy-1-benzofuran-2-yl)-4-pyridinyl]methanamine?
[2-(6-methoxy-1-benzofuran-2-yl)-4-pyridinyl]methanamine has a molecular weight of 254.29 g/mol, XLogP of 2.96, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(6-methoxy-1-benzofuran-2-yl)-4-pyridinyl]methanamine is sourced from PubChem (CID 115113849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).