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

C14H21NO2 — CID 107667317

IUPAC5-ethyl-7-methoxy-N-propyl-2,3-dihydro-1-benzofuran-3-amine
SMILESCCCNC1COc2c(OC)cc(CC)cc21
InChIInChI=1S/C14H21NO2/c1-4-6-15-12-9-17-14-11(12)7-10(5-2)8-13(14)16-3/h7-8,12,15H,4-6,9H2,1-3H3
InChIKeyYQDDCCVUIKHQFT-UHFFFAOYSA-N
MW235.33 g/mol
LogP2.69
Rot. Bonds5

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

5-ethyl-7-methoxy-N-propyl-2,3-dihydro-1-benzofuran-3-amine (PubChem CID 107667317) has the molecular formula C14H21NO2 and a molecular weight of 235.33 g/mol. Its IUPAC name is 5-ethyl-7-methoxy-N-propyl-2,3-dihydro-1-benzofuran-3-amine.

Molecular Properties

Compound Name5-ethyl-7-methoxy-N-propyl-2,3-dihydro-1-benzofuran-3-amine
PubChem CID107667317
Molecular FormulaC14H21NO2
Molecular Weight235.33 g/mol
Exact Mass235.16
IUPAC Name5-ethyl-7-methoxy-N-propyl-2,3-dihydro-1-benzofuran-3-amine
SMILESCCCNC1COc2c(OC)cc(CC)cc21
InChIInChI=1S/C14H21NO2/c1-4-6-15-12-9-17-14-11(12)7-10(5-2)8-13(14)16-3/h7-8,12,15H,4-6,9H2,1-3H3
InChIKeyYQDDCCVUIKHQFT-UHFFFAOYSA-N
XLogP2.69
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,6-diethyl-8-methoxy-3,4-dihydro-2H-chromen-4-amine
CID 107667267
5-ethyl-7-methoxy-2-methyl-N-propyl-2,3-dihydro-1-benzofuran-3-amine
CID 107667280
N,6-diethyl-8-methoxy-2,2-dimethyl-3,4-dihydrochromen-4-amine
CID 107667295
8-methoxy-2,2,6-trimethyl-N-propyl-3,4-dihydrochromen-4-amine
CID 64696641
7-methyl-N-propyl-2,3-dihydro-1-benzofuran-3-amine
CID 43511879
6-ethyl-N,8-dimethoxy-2,2-dimethyl-3,4-dihydrochromen-4-amine
CID 107667337
5-ethyl-N,7-dimethoxy-2-propyl-2,3-dihydro-1-benzofuran-3-amine
CID 107667287
N,5-diethyl-7-methoxy-2-methyl-2,3-dihydro-1-benzofuran-3-amine
CID 107667278
5-ethyl-7-methoxy-2,3-dihydro-1-benzofuran
CID 170265985
5-methyl-N-propyl-2,3-dihydro-1-benzofuran-3-amine
CID 43511864
5,6,7-trimethoxy-4-methyl-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 115417654
6-ethyl-3-methyl-N-propyl-2,3-dihydro-1H-inden-1-amine
CID 63823010

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-7-methoxy-N-propyl-2,3-dihydro-1-benzofuran-3-amine?
The IUPAC name of 5-ethyl-7-methoxy-N-propyl-2,3-dihydro-1-benzofuran-3-amine (CID 107667317) is 5-ethyl-7-methoxy-N-propyl-2,3-dihydro-1-benzofuran-3-amine.
What is the SMILES notation for 5-ethyl-7-methoxy-N-propyl-2,3-dihydro-1-benzofuran-3-amine?
The canonical SMILES for 5-ethyl-7-methoxy-N-propyl-2,3-dihydro-1-benzofuran-3-amine is CCCNC1COc2c(OC)cc(CC)cc21.
What is the InChIKey of 5-ethyl-7-methoxy-N-propyl-2,3-dihydro-1-benzofuran-3-amine?
The InChIKey is YQDDCCVUIKHQFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO2/c1-4-6-15-12-9-17-14-11(12)7-10(5-2)8-13(14)16-3/h7-8,12,15H,4-6,9H2,1-3H3.
What are the key properties of 5-ethyl-7-methoxy-N-propyl-2,3-dihydro-1-benzofuran-3-amine?
5-ethyl-7-methoxy-N-propyl-2,3-dihydro-1-benzofuran-3-amine has a molecular weight of 235.33 g/mol, XLogP of 2.69, 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-N-propyl-2,3-dihydro-1-benzofuran-3-amine is sourced from PubChem (CID 107667317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).