2-[4-(1-benzofuran-2-yl)-2-pyridinyl]ethanamine

C15H14N2O — CID 82388761

IUPAC2-[4-(1-benzofuran-2-yl)-2-pyridinyl]ethanamine
SMILESNCCc1cc(-c2cc3ccccc3o2)ccn1
InChIInChI=1S/C15H14N2O/c16-7-5-13-9-12(6-8-17-13)15-10-11-3-1-2-4-14(11)18-15/h1-4,6,8-10H,5,7,16H2
InChIKeyBKKQGLZVDDUJRK-UHFFFAOYSA-N
MW238.29 g/mol
LogP3.00
Rot. Bonds3

About 2-[4-(1-benzofuran-2-yl)-2-pyridinyl]ethanamine

2-[4-(1-benzofuran-2-yl)-2-pyridinyl]ethanamine (PubChem CID 82388761) has the molecular formula C15H14N2O and a molecular weight of 238.29 g/mol. Its IUPAC name is 2-[4-(1-benzofuran-2-yl)-2-pyridinyl]ethanamine.

Molecular Properties

Compound Name2-[4-(1-benzofuran-2-yl)-2-pyridinyl]ethanamine
PubChem CID82388761
Molecular FormulaC15H14N2O
Molecular Weight238.29 g/mol
Exact Mass238.11
IUPAC Name2-[4-(1-benzofuran-2-yl)-2-pyridinyl]ethanamine
SMILESNCCc1cc(-c2cc3ccccc3o2)ccn1
InChIInChI=1S/C15H14N2O/c16-7-5-13-9-12(6-8-17-13)15-10-11-3-1-2-4-14(11)18-15/h1-4,6,8-10H,5,7,16H2
InChIKeyBKKQGLZVDDUJRK-UHFFFAOYSA-N
XLogP3.00
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[4-(1-benzofuran-2-yl)phenyl]ethanamine
CID 110282118
[2-(1-benzofuran-2-yl)-1H-imidazol-5-yl]methanamine
CID 63108798
N'-[4-(1-benzofuran-2-yl)pyrimidin-2-yl]ethane-1,2-diamine
CID 103278875
3-(1-benzofuran-2-yl)pyrazin-2-amine
CID 114734408
2-[5-(1-benzofuran-2-yl)-1-methylpyrrol-2-yl]ethanamine
CID 82387904
2,5-bis(1-benzofuran-2-yl)pyrazine
CID 86184221
[3-[4-(1-benzofuran-2-yl)-1,3-thiazol-2-yl]phenyl]methanamine
CID 20983781
4-[4-(1-benzofuran-2-yl)-1,3-thiazol-2-yl]aniline
CID 43667812
[2-(1-benzofuran-2-yl)-4-chlorophenyl]methanamine
CID 114732195
2-[3-(4-chlorophenyl)phenyl]-1-benzofuran
CID 170402405
5-(1-benzofuran-2-yl)-2-methylpyridine
CID 146179500
6-(1-benzofuran-2-yl)-2H-triazolo[4,5-b]pyridine
CID 119058904

Frequently Asked Questions

What is the IUPAC name of 2-[4-(1-benzofuran-2-yl)-2-pyridinyl]ethanamine?
The IUPAC name of 2-[4-(1-benzofuran-2-yl)-2-pyridinyl]ethanamine (CID 82388761) is 2-[4-(1-benzofuran-2-yl)-2-pyridinyl]ethanamine.
What is the SMILES notation for 2-[4-(1-benzofuran-2-yl)-2-pyridinyl]ethanamine?
The canonical SMILES for 2-[4-(1-benzofuran-2-yl)-2-pyridinyl]ethanamine is NCCc1cc(-c2cc3ccccc3o2)ccn1.
What is the InChIKey of 2-[4-(1-benzofuran-2-yl)-2-pyridinyl]ethanamine?
The InChIKey is BKKQGLZVDDUJRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O/c16-7-5-13-9-12(6-8-17-13)15-10-11-3-1-2-4-14(11)18-15/h1-4,6,8-10H,5,7,16H2.
What are the key properties of 2-[4-(1-benzofuran-2-yl)-2-pyridinyl]ethanamine?
2-[4-(1-benzofuran-2-yl)-2-pyridinyl]ethanamine has a molecular weight of 238.29 g/mol, XLogP of 3.00, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(1-benzofuran-2-yl)-2-pyridinyl]ethanamine is sourced from PubChem (CID 82388761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).