(1R)-1-[(3R)-2,3-dihydro-1-benzofuran-3-yl]ethanamine

C10H13NO — CID 96839651

IUPAC(1R)-1-[(3R)-2,3-dihydro-1-benzofuran-3-yl]ethanamine
SMILESC[C@@H](N)[C@@H]1COc2ccccc21
InChIInChI=1S/C10H13NO/c1-7(11)9-6-12-10-5-3-2-4-8(9)10/h2-5,7,9H,6,11H2,1H3/t7-,9+/m1/s1
InChIKeyJSAWVKCPAYDQPL-APPZFPTMSA-N
MW163.22 g/mol
LogP1.51
Rot. Bonds1

About (1R)-1-[(3R)-2,3-dihydro-1-benzofuran-3-yl]ethanamine

(1R)-1-[(3R)-2,3-dihydro-1-benzofuran-3-yl]ethanamine (PubChem CID 96839651) has the molecular formula C10H13NO and a molecular weight of 163.22 g/mol. Its IUPAC name is (1R)-1-[(3R)-2,3-dihydro-1-benzofuran-3-yl]ethanamine.

Molecular Properties

Compound Name(1R)-1-[(3R)-2,3-dihydro-1-benzofuran-3-yl]ethanamine
PubChem CID96839651
Molecular FormulaC10H13NO
Molecular Weight163.22 g/mol
Exact Mass163.10
IUPAC Name(1R)-1-[(3R)-2,3-dihydro-1-benzofuran-3-yl]ethanamine
SMILESC[C@@H](N)[C@@H]1COc2ccccc21
InChIInChI=1S/C10H13NO/c1-7(11)9-6-12-10-5-3-2-4-8(9)10/h2-5,7,9H,6,11H2,1H3/t7-,9+/m1/s1
InChIKeyJSAWVKCPAYDQPL-APPZFPTMSA-N
XLogP1.51
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.22
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(5-fluoro-2,3-dihydro-1-benzofuran-3-yl)ethanamine
CID 83906491
[2,3-dihydro-1-benzofuran-3-yl-(4-propan-2-ylphenyl)methyl]hydrazine
CID 105262807
1-(2,3-dihydro-1-benzofuran-3-yl)-4-methylpent-4-en-1-amine
CID 114475780
[1-(2,3-dihydro-1-benzofuran-3-yl)-2-ethylbutyl]hydrazine
CID 105262585
3-[(E)-4-phenylbut-3-en-2-yl]-2,3-dihydro-1-benzofuran
CID 102100111
1-(7-fluoro-2,3-dihydro-1-benzofuran-3-yl)ethanamine
CID 83906490
(3S,4R)-3-propan-2-yl-3,4-dihydro-2H-chromen-4-amine
CID 174973153
[1-(2,3-dihydro-1-benzofuran-3-yl)-3-methylhexyl]hydrazine
CID 105262689
(3R)-2,3-dihydro-1-benzofuran-3-amine
CID 40787193
[cyclobutyl(2,3-dihydro-1-benzofuran-3-yl)methyl]hydrazine
CID 105262779
(4S)-3-methyl-3,4-dihydro-2H-chromen-4-amine
CID 68776309
(4-cyclopropyloxyphenyl)-(2,3-dihydro-1-benzofuran-3-yl)methanamine
CID 114519731

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[(3R)-2,3-dihydro-1-benzofuran-3-yl]ethanamine?
The IUPAC name of (1R)-1-[(3R)-2,3-dihydro-1-benzofuran-3-yl]ethanamine (CID 96839651) is (1R)-1-[(3R)-2,3-dihydro-1-benzofuran-3-yl]ethanamine.
What is the SMILES notation for (1R)-1-[(3R)-2,3-dihydro-1-benzofuran-3-yl]ethanamine?
The canonical SMILES for (1R)-1-[(3R)-2,3-dihydro-1-benzofuran-3-yl]ethanamine is C[C@@H](N)[C@@H]1COc2ccccc21.
What is the InChIKey of (1R)-1-[(3R)-2,3-dihydro-1-benzofuran-3-yl]ethanamine?
The InChIKey is JSAWVKCPAYDQPL-APPZFPTMSA-N. The full InChI is InChI=1S/C10H13NO/c1-7(11)9-6-12-10-5-3-2-4-8(9)10/h2-5,7,9H,6,11H2,1H3/t7-,9+/m1/s1.
What are the key properties of (1R)-1-[(3R)-2,3-dihydro-1-benzofuran-3-yl]ethanamine?
(1R)-1-[(3R)-2,3-dihydro-1-benzofuran-3-yl]ethanamine has a molecular weight of 163.22 g/mol, XLogP of 1.51, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[(3R)-2,3-dihydro-1-benzofuran-3-yl]ethanamine is sourced from PubChem (CID 96839651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).