2,3-dihydro-1-benzofuran-7-yl-(2-methyl-4-pyridinyl)methanamine

C15H16N2O — CID 106755970

IUPAC2,3-dihydro-1-benzofuran-7-yl-(2-methyl-4-pyridinyl)methanamine
SMILESCc1cc(C(N)c2cccc3c2OCC3)ccn1
InChIInChI=1S/C15H16N2O/c1-10-9-12(5-7-17-10)14(16)13-4-2-3-11-6-8-18-15(11)13/h2-5,7,9,14H,6,8,16H2,1H3
InChIKeyCOJSROXYZIUGHL-UHFFFAOYSA-N
MW240.31 g/mol
LogP2.37
Rot. Bonds2

About 2,3-dihydro-1-benzofuran-7-yl-(2-methyl-4-pyridinyl)methanamine

2,3-dihydro-1-benzofuran-7-yl-(2-methyl-4-pyridinyl)methanamine (PubChem CID 106755970) has the molecular formula C15H16N2O and a molecular weight of 240.31 g/mol. Its IUPAC name is 2,3-dihydro-1-benzofuran-7-yl-(2-methyl-4-pyridinyl)methanamine.

Molecular Properties

Compound Name2,3-dihydro-1-benzofuran-7-yl-(2-methyl-4-pyridinyl)methanamine
PubChem CID106755970
Molecular FormulaC15H16N2O
Molecular Weight240.31 g/mol
Exact Mass240.13
IUPAC Name2,3-dihydro-1-benzofuran-7-yl-(2-methyl-4-pyridinyl)methanamine
SMILESCc1cc(C(N)c2cccc3c2OCC3)ccn1
InChIInChI=1S/C15H16N2O/c1-10-9-12(5-7-17-10)14(16)13-4-2-3-11-6-8-18-15(11)13/h2-5,7,9,14H,6,8,16H2,1H3
InChIKeyCOJSROXYZIUGHL-UHFFFAOYSA-N
XLogP2.37
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.31
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3-chloro-4-methylphenyl)-(2,3-dihydro-1-benzofuran-7-yl)methanamine
CID 105053279
2,3-dihydro-1-benzofuran-5-yl(2,3-dihydro-1-benzofuran-7-yl)methanamine
CID 105053322
2,3-dihydro-1-benzofuran-7-yl-(3,4,5-trifluorophenyl)methanamine
CID 114745149
2,3-dihydro-1-benzofuran-7-yl-(5-methyl-1-benzofuran-2-yl)methanamine
CID 105189386
2,3-dihydro-1-benzofuran-7-yl(thiophen-3-yl)methanamine
CID 114744888
2,3-dihydro-1-benzofuran-7-yl-(2-fluoro-4-methylphenyl)methanamine
CID 105053341
2,3-dihydro-1-benzofuran-7-yl-(2-methoxy-5-methylphenyl)methanamine
CID 105053233
3,4-dihydro-2H-chromen-8-yl(pyrimidin-2-yl)methanamine
CID 114744922
3,4-dihydro-2H-chromen-8-yl-(3-methoxyphenyl)methanamine
CID 114744832
3,4-dihydro-2H-chromen-8-yl(pyridin-3-yl)methanamine
CID 114744886
3,4-dihydro-2H-chromen-8-yl-(3-ethyl-6-methylpyridazin-4-yl)methanamine
CID 105187281
1-(2,3-dihydro-1-benzofuran-7-yl)-3,3-dimethylbutan-1-amine
CID 114745358

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-1-benzofuran-7-yl-(2-methyl-4-pyridinyl)methanamine?
The IUPAC name of 2,3-dihydro-1-benzofuran-7-yl-(2-methyl-4-pyridinyl)methanamine (CID 106755970) is 2,3-dihydro-1-benzofuran-7-yl-(2-methyl-4-pyridinyl)methanamine.
What is the SMILES notation for 2,3-dihydro-1-benzofuran-7-yl-(2-methyl-4-pyridinyl)methanamine?
The canonical SMILES for 2,3-dihydro-1-benzofuran-7-yl-(2-methyl-4-pyridinyl)methanamine is Cc1cc(C(N)c2cccc3c2OCC3)ccn1.
What is the InChIKey of 2,3-dihydro-1-benzofuran-7-yl-(2-methyl-4-pyridinyl)methanamine?
The InChIKey is COJSROXYZIUGHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O/c1-10-9-12(5-7-17-10)14(16)13-4-2-3-11-6-8-18-15(11)13/h2-5,7,9,14H,6,8,16H2,1H3.
What are the key properties of 2,3-dihydro-1-benzofuran-7-yl-(2-methyl-4-pyridinyl)methanamine?
2,3-dihydro-1-benzofuran-7-yl-(2-methyl-4-pyridinyl)methanamine has a molecular weight of 240.31 g/mol, XLogP of 2.37, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydro-1-benzofuran-7-yl-(2-methyl-4-pyridinyl)methanamine is sourced from PubChem (CID 106755970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).