1-(1,3-dihydro-2-benzofuran-5-yl)-2-pyridin-2-ylethanamine

C15H16N2O — CID 63744022

IUPAC1-(1,3-dihydro-2-benzofuran-5-yl)-2-pyridin-2-ylethanamine
SMILESNC(Cc1ccccn1)c1ccc2c(c1)COC2
InChIInChI=1S/C15H16N2O/c16-15(8-14-3-1-2-6-17-14)11-4-5-12-9-18-10-13(12)7-11/h1-7,15H,8-10,16H2
InChIKeyKSXDFZGCTCEOIJ-UHFFFAOYSA-N
MW240.31 g/mol
LogP2.35
Rot. Bonds3

About 1-(1,3-dihydro-2-benzofuran-5-yl)-2-pyridin-2-ylethanamine

1-(1,3-dihydro-2-benzofuran-5-yl)-2-pyridin-2-ylethanamine (PubChem CID 63744022) has the molecular formula C15H16N2O and a molecular weight of 240.31 g/mol. Its IUPAC name is 1-(1,3-dihydro-2-benzofuran-5-yl)-2-pyridin-2-ylethanamine.

Molecular Properties

Compound Name1-(1,3-dihydro-2-benzofuran-5-yl)-2-pyridin-2-ylethanamine
PubChem CID63744022
Molecular FormulaC15H16N2O
Molecular Weight240.31 g/mol
Exact Mass240.13
IUPAC Name1-(1,3-dihydro-2-benzofuran-5-yl)-2-pyridin-2-ylethanamine
SMILESNC(Cc1ccccn1)c1ccc2c(c1)COC2
InChIInChI=1S/C15H16N2O/c16-15(8-14-3-1-2-6-17-14)11-4-5-12-9-18-10-13(12)7-11/h1-7,15H,8-10,16H2
InChIKeyKSXDFZGCTCEOIJ-UHFFFAOYSA-N
XLogP2.35
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.31
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-2-(1,3-dihydro-2-benzofuran-5-yl)ethanol
CID 82600093
1-(3-fluoro-4-methylphenyl)-2-pyridin-2-ylethanamine
CID 43118868
1-(1,3-dihydro-2-benzofuran-5-yl)-2-methoxyethanamine
CID 105008898
(1R)-2-pyridin-2-yl-1-pyridin-3-ylethanamine
CID 93256959
(1S)-1-(2,3,4,5,6-pentadeuteriophenyl)-2-pyridin-2-ylethanamine
CID 162640474
1-(5-bromothiophen-3-yl)-2-pyridin-2-ylethanamine
CID 105158058
1-(1,3-dihydro-2-benzofuran-5-yl)-2-(3-methoxyphenyl)ethanamine
CID 63021274
1-(1,3-dihydro-2-benzofuran-5-yl)-2-pyridin-2-ylethanone
CID 63743858
1-(3-fluoro-5-methylphenyl)-2-pyridin-2-ylethanamine
CID 79703275
1-(1,3-dihydro-2-benzofuran-5-yl)octan-1-amine
CID 63020921
1-(3-propoxyphenyl)-2-pyridin-2-ylethanamine
CID 55131965
(1R)-1-(1,3-dihydro-2-benzofuran-5-yl)ethanamine
CID 82759253

Frequently Asked Questions

What is the IUPAC name of 1-(1,3-dihydro-2-benzofuran-5-yl)-2-pyridin-2-ylethanamine?
The IUPAC name of 1-(1,3-dihydro-2-benzofuran-5-yl)-2-pyridin-2-ylethanamine (CID 63744022) is 1-(1,3-dihydro-2-benzofuran-5-yl)-2-pyridin-2-ylethanamine.
What is the SMILES notation for 1-(1,3-dihydro-2-benzofuran-5-yl)-2-pyridin-2-ylethanamine?
The canonical SMILES for 1-(1,3-dihydro-2-benzofuran-5-yl)-2-pyridin-2-ylethanamine is NC(Cc1ccccn1)c1ccc2c(c1)COC2.
What is the InChIKey of 1-(1,3-dihydro-2-benzofuran-5-yl)-2-pyridin-2-ylethanamine?
The InChIKey is KSXDFZGCTCEOIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O/c16-15(8-14-3-1-2-6-17-14)11-4-5-12-9-18-10-13(12)7-11/h1-7,15H,8-10,16H2.
What are the key properties of 1-(1,3-dihydro-2-benzofuran-5-yl)-2-pyridin-2-ylethanamine?
1-(1,3-dihydro-2-benzofuran-5-yl)-2-pyridin-2-ylethanamine has a molecular weight of 240.31 g/mol, XLogP of 2.35, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,3-dihydro-2-benzofuran-5-yl)-2-pyridin-2-ylethanamine is sourced from PubChem (CID 63744022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).