(3R)-7-ethyl-5-methoxy-2,3-dihydro-1-benzofuran-3-amine

C11H15NO2 — CID 130609262

IUPAC(3R)-7-ethyl-5-methoxy-2,3-dihydro-1-benzofuran-3-amine
SMILESCCc1cc(OC)cc2c1OC[C@@H]2N
InChIInChI=1S/C11H15NO2/c1-3-7-4-8(13-2)5-9-10(12)6-14-11(7)9/h4-5,10H,3,6,12H2,1-2H3/t10-/m0/s1
InChIKeyAYGNMUSSOVYHJZ-JTQLQIEISA-N
MW193.25 g/mol
LogP1.65
Rot. Bonds2

About (3R)-7-ethyl-5-methoxy-2,3-dihydro-1-benzofuran-3-amine

(3R)-7-ethyl-5-methoxy-2,3-dihydro-1-benzofuran-3-amine (PubChem CID 130609262) has the molecular formula C11H15NO2 and a molecular weight of 193.25 g/mol. Its IUPAC name is (3R)-7-ethyl-5-methoxy-2,3-dihydro-1-benzofuran-3-amine.

Molecular Properties

Compound Name(3R)-7-ethyl-5-methoxy-2,3-dihydro-1-benzofuran-3-amine
PubChem CID130609262
Molecular FormulaC11H15NO2
Molecular Weight193.25 g/mol
Exact Mass193.11
IUPAC Name(3R)-7-ethyl-5-methoxy-2,3-dihydro-1-benzofuran-3-amine
SMILESCCc1cc(OC)cc2c1OC[C@@H]2N
InChIInChI=1S/C11H15NO2/c1-3-7-4-8(13-2)5-9-10(12)6-14-11(7)9/h4-5,10H,3,6,12H2,1-2H3/t10-/m0/s1
InChIKeyAYGNMUSSOVYHJZ-JTQLQIEISA-N
XLogP1.65
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3R)-5-ethoxy-7-iodo-2,3-dihydro-1-benzofuran-3-amine
CID 130612649
3-amino-6,7-dimethoxy-2,3-dihydro-1-benzofuran-5-ol
CID 86192290
(3R)-5,6-difluoro-7-methoxy-2,3-dihydro-1-benzofuran-3-amine
CID 131075554
(4R)-8-bromo-6-methoxy-3,4-dihydro-2H-chromen-4-amine
CID 103693937
5,6-dimethoxy-2,3-dihydro-1-benzofuran-3-amine
CID 55269219
5-methoxy-2,3-dihydro-1-benzofuran-3,7-diol
CID 139807166
(4S)-8-fluoro-6-methoxy-3,4-dihydro-2H-chromen-4-amine;hydrochloride
CID 171252232
(3R)-7-bromo-4-ethyl-2,3-dihydro-1-benzofuran-3-amine
CID 130741328
(3S)-7-ethyl-6-iodo-2,3-dihydro-1-benzofuran-3-amine
CID 130739663
(3R)-4-ethyl-2,3-dihydro-1-benzofuran-3,7-diamine
CID 130643053
6-methoxy-2,3-dihydro-1-benzofuran-3,5-diamine
CID 55294789
(3S)-3-amino-7-methyl-2,3-dihydro-1-benzofuran-5-ol
CID 130992672

Frequently Asked Questions

What is the IUPAC name of (3R)-7-ethyl-5-methoxy-2,3-dihydro-1-benzofuran-3-amine?
The IUPAC name of (3R)-7-ethyl-5-methoxy-2,3-dihydro-1-benzofuran-3-amine (CID 130609262) is (3R)-7-ethyl-5-methoxy-2,3-dihydro-1-benzofuran-3-amine.
What is the SMILES notation for (3R)-7-ethyl-5-methoxy-2,3-dihydro-1-benzofuran-3-amine?
The canonical SMILES for (3R)-7-ethyl-5-methoxy-2,3-dihydro-1-benzofuran-3-amine is CCc1cc(OC)cc2c1OC[C@@H]2N.
What is the InChIKey of (3R)-7-ethyl-5-methoxy-2,3-dihydro-1-benzofuran-3-amine?
The InChIKey is AYGNMUSSOVYHJZ-JTQLQIEISA-N. The full InChI is InChI=1S/C11H15NO2/c1-3-7-4-8(13-2)5-9-10(12)6-14-11(7)9/h4-5,10H,3,6,12H2,1-2H3/t10-/m0/s1.
What are the key properties of (3R)-7-ethyl-5-methoxy-2,3-dihydro-1-benzofuran-3-amine?
(3R)-7-ethyl-5-methoxy-2,3-dihydro-1-benzofuran-3-amine has a molecular weight of 193.25 g/mol, XLogP of 1.65, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-7-ethyl-5-methoxy-2,3-dihydro-1-benzofuran-3-amine is sourced from PubChem (CID 130609262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).