(1R)-1-(1-benzofuran-2-yl)ethanamine;hydrochloride

C10H12ClNO — CID 75525569

IUPAC(1R)-1-(1-benzofuran-2-yl)ethanamine;hydrochloride
SMILESC[C@@H](N)c1cc2ccccc2o1.Cl
InChIInChI=1S/C10H11NO.ClH/c1-7(11)10-6-8-4-2-3-5-9(8)12-10;/h2-7H,11H2,1H3;1H/t7-;/m1./s1
InChIKeyXOFRZNVJGNVDIQ-OGFXRTJISA-N
MW197.67 g/mol
LogP2.87
Rot. Bonds1

About (1R)-1-(1-benzofuran-2-yl)ethanamine;hydrochloride

(1R)-1-(1-benzofuran-2-yl)ethanamine;hydrochloride (PubChem CID 75525569) has the molecular formula C10H12ClNO and a molecular weight of 197.67 g/mol. Its IUPAC name is (1R)-1-(1-benzofuran-2-yl)ethanamine;hydrochloride.

Molecular Properties

Compound Name(1R)-1-(1-benzofuran-2-yl)ethanamine;hydrochloride
PubChem CID75525569
Molecular FormulaC10H12ClNO
Molecular Weight197.67 g/mol
Exact Mass197.06
IUPAC Name(1R)-1-(1-benzofuran-2-yl)ethanamine;hydrochloride
SMILESC[C@@H](N)c1cc2ccccc2o1.Cl
InChIInChI=1S/C10H11NO.ClH/c1-7(11)10-6-8-4-2-3-5-9(8)12-10;/h2-7H,11H2,1H3;1H/t7-;/m1./s1
InChIKeyXOFRZNVJGNVDIQ-OGFXRTJISA-N
XLogP2.87
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.67
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-butan-2-yl-1-benzofuran
CID 12065919
2-amino-2-(1-benzofuran-2-yl)ethanol
CID 54265707
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CID 119272375
1-benzofuran-2-yl-(5-methyl-1-benzofuran-2-yl)methanamine
CID 63326539
1-(1-benzofuran-2-yl)-2-ethoxypropan-1-amine
CID 114728782
1-benzofuran-2-yl-(4-methylcyclohexyl)methanamine
CID 64776063
1-(5-propyl-1-benzofuran-2-yl)ethanamine
CID 65439611
1-(1-benzofuran-2-yl)-4-methoxy-3-methylbutan-1-amine
CID 105184765
N-[(1R)-1-(1-benzofuran-2-yl)ethyl]-1-benzofuran-2-carboxamide
CID 9366962
N-[(1S)-1-(1-benzofuran-2-yl)ethyl]-1-benzofuran-2-carboxamide
CID 9366960
1-(1-benzofuran-2-yl)-2-tert-butylsulfanylethanamine
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1-benzofuran-2-yl-(2,4,5-trimethylphenyl)methanamine
CID 60727883

Frequently Asked Questions

What is the IUPAC name of (1R)-1-(1-benzofuran-2-yl)ethanamine;hydrochloride?
The IUPAC name of (1R)-1-(1-benzofuran-2-yl)ethanamine;hydrochloride (CID 75525569) is (1R)-1-(1-benzofuran-2-yl)ethanamine;hydrochloride.
What is the SMILES notation for (1R)-1-(1-benzofuran-2-yl)ethanamine;hydrochloride?
The canonical SMILES for (1R)-1-(1-benzofuran-2-yl)ethanamine;hydrochloride is C[C@@H](N)c1cc2ccccc2o1.Cl.
What is the InChIKey of (1R)-1-(1-benzofuran-2-yl)ethanamine;hydrochloride?
The InChIKey is XOFRZNVJGNVDIQ-OGFXRTJISA-N. The full InChI is InChI=1S/C10H11NO.ClH/c1-7(11)10-6-8-4-2-3-5-9(8)12-10;/h2-7H,11H2,1H3;1H/t7-;/m1./s1.
What are the key properties of (1R)-1-(1-benzofuran-2-yl)ethanamine;hydrochloride?
(1R)-1-(1-benzofuran-2-yl)ethanamine;hydrochloride has a molecular weight of 197.67 g/mol, XLogP of 2.87, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-(1-benzofuran-2-yl)ethanamine;hydrochloride is sourced from PubChem (CID 75525569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).