2,3-dihydro-1-benzofuran-2-yl-(8-methoxy-3,4-dihydro-2H-quinolin-1-yl)methanone

C19H19NO3 — CID 47027785

IUPAC2,3-dihydro-1-benzofuran-2-yl-(8-methoxy-3,4-dihydro-2H-quinolin-1-yl)methanone
SMILESCOc1cccc2c1N(C(=O)C1Cc3ccccc3O1)CCC2
InChIInChI=1S/C19H19NO3/c1-22-16-10-4-7-13-8-5-11-20(18(13)16)19(21)17-12-14-6-2-3-9-15(14)23-17/h2-4,6-7,9-10,17H,5,8,11-12H2,1H3
InChIKeyQFDODRBUFZRHIQ-UHFFFAOYSA-N
MW309.37 g/mol
LogP2.98
Rot. Bonds2

About 2,3-dihydro-1-benzofuran-2-yl-(8-methoxy-3,4-dihydro-2H-quinolin-1-yl)methanone

2,3-dihydro-1-benzofuran-2-yl-(8-methoxy-3,4-dihydro-2H-quinolin-1-yl)methanone (PubChem CID 47027785) has the molecular formula C19H19NO3 and a molecular weight of 309.37 g/mol. Its IUPAC name is 2,3-dihydro-1-benzofuran-2-yl-(8-methoxy-3,4-dihydro-2H-quinolin-1-yl)methanone.

Molecular Properties

Compound Name2,3-dihydro-1-benzofuran-2-yl-(8-methoxy-3,4-dihydro-2H-quinolin-1-yl)methanone
PubChem CID47027785
Molecular FormulaC19H19NO3
Molecular Weight309.37 g/mol
Exact Mass309.14
IUPAC Name2,3-dihydro-1-benzofuran-2-yl-(8-methoxy-3,4-dihydro-2H-quinolin-1-yl)methanone
SMILESCOc1cccc2c1N(C(=O)C1Cc3ccccc3O1)CCC2
InChIInChI=1S/C19H19NO3/c1-22-16-10-4-7-13-8-5-11-20(18(13)16)19(21)17-12-14-6-2-3-9-15(14)23-17/h2-4,6-7,9-10,17H,5,8,11-12H2,1H3
InChIKeyQFDODRBUFZRHIQ-UHFFFAOYSA-N
XLogP2.98
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.37
LogP ≤ 52.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-1-benzofuran-2-yl-(8-methoxy-3,4-dihydro-2H-quinolin-1-yl)methanone?
The IUPAC name of 2,3-dihydro-1-benzofuran-2-yl-(8-methoxy-3,4-dihydro-2H-quinolin-1-yl)methanone (CID 47027785) is 2,3-dihydro-1-benzofuran-2-yl-(8-methoxy-3,4-dihydro-2H-quinolin-1-yl)methanone.
What is the SMILES notation for 2,3-dihydro-1-benzofuran-2-yl-(8-methoxy-3,4-dihydro-2H-quinolin-1-yl)methanone?
The canonical SMILES for 2,3-dihydro-1-benzofuran-2-yl-(8-methoxy-3,4-dihydro-2H-quinolin-1-yl)methanone is COc1cccc2c1N(C(=O)C1Cc3ccccc3O1)CCC2.
What is the InChIKey of 2,3-dihydro-1-benzofuran-2-yl-(8-methoxy-3,4-dihydro-2H-quinolin-1-yl)methanone?
The InChIKey is QFDODRBUFZRHIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19NO3/c1-22-16-10-4-7-13-8-5-11-20(18(13)16)19(21)17-12-14-6-2-3-9-15(14)23-17/h2-4,6-7,9-10,17H,5,8,11-12H2,1H3.
What are the key properties of 2,3-dihydro-1-benzofuran-2-yl-(8-methoxy-3,4-dihydro-2H-quinolin-1-yl)methanone?
2,3-dihydro-1-benzofuran-2-yl-(8-methoxy-3,4-dihydro-2H-quinolin-1-yl)methanone has a molecular weight of 309.37 g/mol, XLogP of 2.98, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydro-1-benzofuran-2-yl-(8-methoxy-3,4-dihydro-2H-quinolin-1-yl)methanone is sourced from PubChem (CID 47027785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).