5-ethyl-7-methoxy-2-methyl-N-propyl-2,3-dihydro-1-benzofuran-3-amine

C15H23NO2 — CID 107667280

IUPAC5-ethyl-7-methoxy-2-methyl-N-propyl-2,3-dihydro-1-benzofuran-3-amine
SMILESCCCNC1c2cc(CC)cc(OC)c2OC1C
InChIInChI=1S/C15H23NO2/c1-5-7-16-14-10(3)18-15-12(14)8-11(6-2)9-13(15)17-4/h8-10,14,16H,5-7H2,1-4H3
InChIKeyXHZKZZQSSSXXOQ-UHFFFAOYSA-N
MW249.35 g/mol
LogP3.08
Rot. Bonds5

About 5-ethyl-7-methoxy-2-methyl-N-propyl-2,3-dihydro-1-benzofuran-3-amine

5-ethyl-7-methoxy-2-methyl-N-propyl-2,3-dihydro-1-benzofuran-3-amine (PubChem CID 107667280) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is 5-ethyl-7-methoxy-2-methyl-N-propyl-2,3-dihydro-1-benzofuran-3-amine.

Molecular Properties

Compound Name5-ethyl-7-methoxy-2-methyl-N-propyl-2,3-dihydro-1-benzofuran-3-amine
PubChem CID107667280
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC Name5-ethyl-7-methoxy-2-methyl-N-propyl-2,3-dihydro-1-benzofuran-3-amine
SMILESCCCNC1c2cc(CC)cc(OC)c2OC1C
InChIInChI=1S/C15H23NO2/c1-5-7-16-14-10(3)18-15-12(14)8-11(6-2)9-13(15)17-4/h8-10,14,16H,5-7H2,1-4H3
InChIKeyXHZKZZQSSSXXOQ-UHFFFAOYSA-N
XLogP3.08
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,5-diethyl-7-methoxy-2-methyl-2,3-dihydro-1-benzofuran-3-amine
CID 107667278
5-ethyl-N,7-dimethoxy-2-propyl-2,3-dihydro-1-benzofuran-3-amine
CID 107667287
5-ethyl-7-methoxy-N-propyl-2,3-dihydro-1-benzofuran-3-amine
CID 107667317
7-tert-butyl-2,5-dimethyl-N-propyl-2,3-dihydro-1-benzofuran-3-amine
CID 63398773
6-bromo-5-fluoro-2-methyl-N-propyl-2,3-dihydro-1-benzofuran-3-amine
CID 83233982
N,6-diethyl-8-methoxy-3,4-dihydro-2H-chromen-4-amine
CID 107667267
N,6-diethyl-8-methoxy-2,2-dimethyl-3,4-dihydrochromen-4-amine
CID 107667295
6-ethyl-N,8-dimethoxy-2,2-dimethyl-3,4-dihydrochromen-4-amine
CID 107667337
6-(2-methoxyethyl)-3-methyl-N-propyl-3,4-dihydro-2H-chromen-4-amine
CID 43537818
7-tert-butyl-2,4-dimethyl-N-propyl-2,3-dihydro-1-benzofuran-3-amine
CID 63398815
5,7-dimethoxy-3-methyl-N-propyl-3,4-dihydro-2H-chromen-4-amine
CID 43589774
5-ethyl-7-methoxy-2,3-dihydro-1-benzofuran
CID 170265985

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-7-methoxy-2-methyl-N-propyl-2,3-dihydro-1-benzofuran-3-amine?
The IUPAC name of 5-ethyl-7-methoxy-2-methyl-N-propyl-2,3-dihydro-1-benzofuran-3-amine (CID 107667280) is 5-ethyl-7-methoxy-2-methyl-N-propyl-2,3-dihydro-1-benzofuran-3-amine.
What is the SMILES notation for 5-ethyl-7-methoxy-2-methyl-N-propyl-2,3-dihydro-1-benzofuran-3-amine?
The canonical SMILES for 5-ethyl-7-methoxy-2-methyl-N-propyl-2,3-dihydro-1-benzofuran-3-amine is CCCNC1c2cc(CC)cc(OC)c2OC1C.
What is the InChIKey of 5-ethyl-7-methoxy-2-methyl-N-propyl-2,3-dihydro-1-benzofuran-3-amine?
The InChIKey is XHZKZZQSSSXXOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2/c1-5-7-16-14-10(3)18-15-12(14)8-11(6-2)9-13(15)17-4/h8-10,14,16H,5-7H2,1-4H3.
What are the key properties of 5-ethyl-7-methoxy-2-methyl-N-propyl-2,3-dihydro-1-benzofuran-3-amine?
5-ethyl-7-methoxy-2-methyl-N-propyl-2,3-dihydro-1-benzofuran-3-amine has a molecular weight of 249.35 g/mol, XLogP of 3.08, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-7-methoxy-2-methyl-N-propyl-2,3-dihydro-1-benzofuran-3-amine is sourced from PubChem (CID 107667280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).