2-(3-cyclopropyl-1-benzofuran-6-yl)ethanamine

C13H15NO — CID 84670147

IUPAC2-(3-cyclopropyl-1-benzofuran-6-yl)ethanamine
SMILESNCCc1ccc2c(C3CC3)coc2c1
InChIInChI=1S/C13H15NO/c14-6-5-9-1-4-11-12(10-2-3-10)8-15-13(11)7-9/h1,4,7-8,10H,2-3,5-6,14H2
InChIKeyHICVWPYHZXFFLX-UHFFFAOYSA-N
MW201.27 g/mol
LogP2.81
Rot. Bonds3

About 2-(3-cyclopropyl-1-benzofuran-6-yl)ethanamine

2-(3-cyclopropyl-1-benzofuran-6-yl)ethanamine (PubChem CID 84670147) has the molecular formula C13H15NO and a molecular weight of 201.27 g/mol. Its IUPAC name is 2-(3-cyclopropyl-1-benzofuran-6-yl)ethanamine.

Molecular Properties

Compound Name2-(3-cyclopropyl-1-benzofuran-6-yl)ethanamine
PubChem CID84670147
Molecular FormulaC13H15NO
Molecular Weight201.27 g/mol
Exact Mass201.12
IUPAC Name2-(3-cyclopropyl-1-benzofuran-6-yl)ethanamine
SMILESNCCc1ccc2c(C3CC3)coc2c1
InChIInChI=1S/C13H15NO/c14-6-5-9-1-4-11-12(10-2-3-10)8-15-13(11)7-9/h1,4,7-8,10H,2-3,5-6,14H2
InChIKeyHICVWPYHZXFFLX-UHFFFAOYSA-N
XLogP2.81
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[6-(aminomethyl)-1-benzofuran-3-yl]piperidine-2,6-dione;hydrochloride
CID 170904716
3-(3-methyl-1-benzofuran-6-yl)propanal
CID 117281065
2-(3-cyclopropylphenyl)ethanamine
CID 79983898
4-(1-benzofuran-3-yl)-1-methylpiperidine
CID 20758862
2-(5-propyl-1-benzofuran-3-yl)ethanamine
CID 81048863
6-ethyl-3-methyl-1-benzofuran
CID 45122551
5-(2-aminoethyl)-1,3-benzodioxol-2-one
CID 84656757
2-(3-cyclohexyl-4-ethoxyphenyl)ethanamine
CID 170888196
2-(3-tert-butyl-1,2-benzoxazol-6-yl)ethanamine
CID 105472824
2-[6-(2-aminoethyl)naphthalen-2-yl]ethanamine
CID 20633654
2-(2,2-dioxo-1,3,2λ6-benzodioxathiol-5-yl)ethanamine
CID 10420824
2-[3,4-bis(1,3-dioxol-2-yl)phenyl]ethanamine
CID 162515752

Frequently Asked Questions

What is the IUPAC name of 2-(3-cyclopropyl-1-benzofuran-6-yl)ethanamine?
The IUPAC name of 2-(3-cyclopropyl-1-benzofuran-6-yl)ethanamine (CID 84670147) is 2-(3-cyclopropyl-1-benzofuran-6-yl)ethanamine.
What is the SMILES notation for 2-(3-cyclopropyl-1-benzofuran-6-yl)ethanamine?
The canonical SMILES for 2-(3-cyclopropyl-1-benzofuran-6-yl)ethanamine is NCCc1ccc2c(C3CC3)coc2c1.
What is the InChIKey of 2-(3-cyclopropyl-1-benzofuran-6-yl)ethanamine?
The InChIKey is HICVWPYHZXFFLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NO/c14-6-5-9-1-4-11-12(10-2-3-10)8-15-13(11)7-9/h1,4,7-8,10H,2-3,5-6,14H2.
What are the key properties of 2-(3-cyclopropyl-1-benzofuran-6-yl)ethanamine?
2-(3-cyclopropyl-1-benzofuran-6-yl)ethanamine has a molecular weight of 201.27 g/mol, XLogP of 2.81, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-cyclopropyl-1-benzofuran-6-yl)ethanamine is sourced from PubChem (CID 84670147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).