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

C17H20N2O — CID 104736733

IUPAC1-(2,3-dihydro-1-benzofuran-2-yl)-N-ethyl-2-pyridin-3-ylethanamine
SMILESCCNC(Cc1cccnc1)C1Cc2ccccc2O1
InChIInChI=1S/C17H20N2O/c1-2-19-15(10-13-6-5-9-18-12-13)17-11-14-7-3-4-8-16(14)20-17/h3-9,12,15,17,19H,2,10-11H2,1H3
InChIKeyOIHZLDHYEOXVGM-UHFFFAOYSA-N
MW268.36 g/mol
LogP2.61
Rot. Bonds5

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

1-(2,3-dihydro-1-benzofuran-2-yl)-N-ethyl-2-pyridin-3-ylethanamine (PubChem CID 104736733) has the molecular formula C17H20N2O and a molecular weight of 268.36 g/mol. Its IUPAC name is 1-(2,3-dihydro-1-benzofuran-2-yl)-N-ethyl-2-pyridin-3-ylethanamine.

Molecular Properties

Compound Name1-(2,3-dihydro-1-benzofuran-2-yl)-N-ethyl-2-pyridin-3-ylethanamine
PubChem CID104736733
Molecular FormulaC17H20N2O
Molecular Weight268.36 g/mol
Exact Mass268.16
IUPAC Name1-(2,3-dihydro-1-benzofuran-2-yl)-N-ethyl-2-pyridin-3-ylethanamine
SMILESCCNC(Cc1cccnc1)C1Cc2ccccc2O1
InChIInChI=1S/C17H20N2O/c1-2-19-15(10-13-6-5-9-18-12-13)17-11-14-7-3-4-8-16(14)20-17/h3-9,12,15,17,19H,2,10-11H2,1H3
InChIKeyOIHZLDHYEOXVGM-UHFFFAOYSA-N
XLogP2.61
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-1-(5-methyloxolan-2-yl)-2-pyridin-3-ylethanamine
CID 105034589
N-ethyl-1-(4-propan-2-ylmorpholin-2-yl)-2-pyridin-3-ylethanamine
CID 104736588
N-ethyl-1-(4-ethylcyclohexyl)-2-pyridin-3-ylethanamine
CID 64776867
N-ethyl-1-(2-ethylcyclohexyl)-2-pyridin-3-ylethanamine
CID 63861666
1-(4-tert-butylcyclohexyl)-N-ethyl-2-pyridin-3-ylethanamine
CID 104736394
N-ethyl-1-(7-oxabicyclo[2.2.1]heptan-2-yl)-2-pyridin-3-ylethanamine
CID 113446951
1-(3,4-dihydro-2H-chromen-3-yl)-N-ethyl-2-phenylethanamine
CID 65410502
1-(2,3-dihydro-1-benzofuran-2-yl)-N-methyl-2-(1,3-thiazol-5-yl)ethanamine
CID 112643567
N-[1-(oxan-2-yl)-2-pyridin-3-ylethyl]propan-1-amine
CID 105034736
N-[(4-chloro-1-methylpyrazol-5-yl)-(2,3-dihydro-1-benzofuran-2-yl)methyl]ethanamine
CID 114660019
1-(2-chlorophenyl)-N-ethyl-3-pyridin-3-ylpropan-2-amine
CID 55086568
[1-(2,3-dihydro-1-benzofuran-2-yl)-2-(1-methylimidazol-2-yl)ethyl]hydrazine
CID 105263048

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydro-1-benzofuran-2-yl)-N-ethyl-2-pyridin-3-ylethanamine?
The IUPAC name of 1-(2,3-dihydro-1-benzofuran-2-yl)-N-ethyl-2-pyridin-3-ylethanamine (CID 104736733) is 1-(2,3-dihydro-1-benzofuran-2-yl)-N-ethyl-2-pyridin-3-ylethanamine.
What is the SMILES notation for 1-(2,3-dihydro-1-benzofuran-2-yl)-N-ethyl-2-pyridin-3-ylethanamine?
The canonical SMILES for 1-(2,3-dihydro-1-benzofuran-2-yl)-N-ethyl-2-pyridin-3-ylethanamine is CCNC(Cc1cccnc1)C1Cc2ccccc2O1.
What is the InChIKey of 1-(2,3-dihydro-1-benzofuran-2-yl)-N-ethyl-2-pyridin-3-ylethanamine?
The InChIKey is OIHZLDHYEOXVGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O/c1-2-19-15(10-13-6-5-9-18-12-13)17-11-14-7-3-4-8-16(14)20-17/h3-9,12,15,17,19H,2,10-11H2,1H3.
What are the key properties of 1-(2,3-dihydro-1-benzofuran-2-yl)-N-ethyl-2-pyridin-3-ylethanamine?
1-(2,3-dihydro-1-benzofuran-2-yl)-N-ethyl-2-pyridin-3-ylethanamine has a molecular weight of 268.36 g/mol, XLogP of 2.61, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydro-1-benzofuran-2-yl)-N-ethyl-2-pyridin-3-ylethanamine is sourced from PubChem (CID 104736733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).