8-(2,3-dihydro-1-benzofuran-3-ylmethoxy)-1,2,3,4-tetrahydroquinoline

C18H19NO2 — CID 79219091

IUPAC8-(2,3-dihydro-1-benzofuran-3-ylmethoxy)-1,2,3,4-tetrahydroquinoline
SMILESc1ccc2c(c1)OCC2COc1cccc2c1NCCC2
InChIInChI=1S/C18H19NO2/c1-2-8-16-15(7-1)14(11-20-16)12-21-17-9-3-5-13-6-4-10-19-18(13)17/h1-3,5,7-9,14,19H,4,6,10-12H2
InChIKeyIWQXOPAGZDCNRA-UHFFFAOYSA-N
MW281.36 g/mol
LogP3.60
Rot. Bonds3

About 8-(2,3-dihydro-1-benzofuran-3-ylmethoxy)-1,2,3,4-tetrahydroquinoline

8-(2,3-dihydro-1-benzofuran-3-ylmethoxy)-1,2,3,4-tetrahydroquinoline (PubChem CID 79219091) has the molecular formula C18H19NO2 and a molecular weight of 281.36 g/mol. Its IUPAC name is 8-(2,3-dihydro-1-benzofuran-3-ylmethoxy)-1,2,3,4-tetrahydroquinoline.

Molecular Properties

Compound Name8-(2,3-dihydro-1-benzofuran-3-ylmethoxy)-1,2,3,4-tetrahydroquinoline
PubChem CID79219091
Molecular FormulaC18H19NO2
Molecular Weight281.36 g/mol
Exact Mass281.14
IUPAC Name8-(2,3-dihydro-1-benzofuran-3-ylmethoxy)-1,2,3,4-tetrahydroquinoline
SMILESc1ccc2c(c1)OCC2COc1cccc2c1NCCC2
InChIInChI=1S/C18H19NO2/c1-2-8-16-15(7-1)14(11-20-16)12-21-17-9-3-5-13-6-4-10-19-18(13)17/h1-3,5,7-9,14,19H,4,6,10-12H2
InChIKeyIWQXOPAGZDCNRA-UHFFFAOYSA-N
XLogP3.60
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 8-(2,3-dihydro-1-benzofuran-3-ylmethoxy)-1,2,3,4-tetrahydroquinoline with MolForge

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Related Compounds

8-[(1-methylpiperidin-3-yl)methoxy]-1,2,3,4-tetrahydroquinoline
CID 115075706
8-(2,3-dihydro-1-benzothiophen-2-ylmethoxy)-1,2,3,4-tetrahydroquinoline
CID 79228546
8-[(1-ethylpiperidin-4-yl)methoxy]-1,2,3,4-tetrahydroquinoline
CID 115075693
3-[(2,5-dimethylphenoxy)methyl]-2,3-dihydro-1-benzofuran
CID 81005013
8-[(5,5-dimethyloxolan-2-yl)methoxy]-1,2,3,4-tetrahydroquinoline
CID 116522225
8-(3-phenoxypropoxy)-1,2,3,4-tetrahydroquinoline
CID 61027161
8-(2,2,2-trifluoroethoxy)-1,2,3,4-tetrahydroquinoline
CID 16781925
3-(1,2,3,4-tetrahydroquinolin-8-yloxy)propan-1-ol
CID 61027554
8-(3-phenylpropoxy)-1,2,3,4-tetrahydroquinoline
CID 28553513
(1S)-1-[2-(2,3-dihydro-1-benzofuran-3-ylmethoxy)phenyl]propan-1-amine
CID 79218494
2-chloro-6-(2,3-dihydro-1-benzofuran-3-ylmethoxy)benzoic acid
CID 114320330
O-(2,3-dihydro-1-benzofuran-3-ylmethyl)hydroxylamine
CID 79426928

Frequently Asked Questions

What is the IUPAC name of 8-(2,3-dihydro-1-benzofuran-3-ylmethoxy)-1,2,3,4-tetrahydroquinoline?
The IUPAC name of 8-(2,3-dihydro-1-benzofuran-3-ylmethoxy)-1,2,3,4-tetrahydroquinoline (CID 79219091) is 8-(2,3-dihydro-1-benzofuran-3-ylmethoxy)-1,2,3,4-tetrahydroquinoline.
What is the SMILES notation for 8-(2,3-dihydro-1-benzofuran-3-ylmethoxy)-1,2,3,4-tetrahydroquinoline?
The canonical SMILES for 8-(2,3-dihydro-1-benzofuran-3-ylmethoxy)-1,2,3,4-tetrahydroquinoline is c1ccc2c(c1)OCC2COc1cccc2c1NCCC2.
What is the InChIKey of 8-(2,3-dihydro-1-benzofuran-3-ylmethoxy)-1,2,3,4-tetrahydroquinoline?
The InChIKey is IWQXOPAGZDCNRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19NO2/c1-2-8-16-15(7-1)14(11-20-16)12-21-17-9-3-5-13-6-4-10-19-18(13)17/h1-3,5,7-9,14,19H,4,6,10-12H2.
What are the key properties of 8-(2,3-dihydro-1-benzofuran-3-ylmethoxy)-1,2,3,4-tetrahydroquinoline?
8-(2,3-dihydro-1-benzofuran-3-ylmethoxy)-1,2,3,4-tetrahydroquinoline has a molecular weight of 281.36 g/mol, XLogP of 3.60, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(2,3-dihydro-1-benzofuran-3-ylmethoxy)-1,2,3,4-tetrahydroquinoline is sourced from PubChem (CID 79219091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).