(8-methoxy-3,4-dihydro-2H-quinolin-1-yl)-[5-(phenoxymethyl)furan-2-yl]methanone

C22H21NO4 — CID 43066677

IUPAC(8-methoxy-3,4-dihydro-2H-quinolin-1-yl)-[5-(phenoxymethyl)furan-2-yl]methanone
SMILESCOc1cccc2c1N(C(=O)c1ccc(COc3ccccc3)o1)CCC2
InChIInChI=1S/C22H21NO4/c1-25-19-11-5-7-16-8-6-14-23(21(16)19)22(24)20-13-12-18(27-20)15-26-17-9-3-2-4-10-17/h2-5,7,9-13H,6,8,14-15H2,1H3
InChIKeyIAKJLSRHPVTKSH-UHFFFAOYSA-N
MW363.41 g/mol
LogP4.46
Rot. Bonds5

About (8-methoxy-3,4-dihydro-2H-quinolin-1-yl)-[5-(phenoxymethyl)furan-2-yl]methanone

(8-methoxy-3,4-dihydro-2H-quinolin-1-yl)-[5-(phenoxymethyl)furan-2-yl]methanone (PubChem CID 43066677) has the molecular formula C22H21NO4 and a molecular weight of 363.41 g/mol. Its IUPAC name is (8-methoxy-3,4-dihydro-2H-quinolin-1-yl)-[5-(phenoxymethyl)furan-2-yl]methanone.

Molecular Properties

Compound Name(8-methoxy-3,4-dihydro-2H-quinolin-1-yl)-[5-(phenoxymethyl)furan-2-yl]methanone
PubChem CID43066677
Molecular FormulaC22H21NO4
Molecular Weight363.41 g/mol
Exact Mass363.15
IUPAC Name(8-methoxy-3,4-dihydro-2H-quinolin-1-yl)-[5-(phenoxymethyl)furan-2-yl]methanone
SMILESCOc1cccc2c1N(C(=O)c1ccc(COc3ccccc3)o1)CCC2
InChIInChI=1S/C22H21NO4/c1-25-19-11-5-7-16-8-6-14-23(21(16)19)22(24)20-13-12-18(27-20)15-26-17-9-3-2-4-10-17/h2-5,7,9-13H,6,8,14-15H2,1H3
InChIKeyIAKJLSRHPVTKSH-UHFFFAOYSA-N
XLogP4.46
TPSA51.91 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.41
LogP ≤ 54.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze (8-methoxy-3,4-dihydro-2H-quinolin-1-yl)-[5-(phenoxymethyl)furan-2-yl]methanone with MolForge

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Related Compounds

2,3-dihydroindol-1-yl-[5-(phenoxymethyl)furan-2-yl]methanone
CID 17409583
(3,4-dimethoxyphenyl)-(8-methoxy-3,4-dihydro-2H-quinolin-1-yl)methanone
CID 17234056
3,4-dihydro-1H-isoquinolin-2-yl-[5-[(2-methoxyphenoxy)methyl]furan-2-yl]methanone
CID 1084331
2-bromo-1-(8-methoxy-3,4-dihydro-2H-quinolin-1-yl)ethanone
CID 63681436
[5-[(2-methoxyphenoxy)methyl]furan-2-yl]-piperidin-1-ylmethanone
CID 1084341
(8-methoxy-3,4-dihydro-2H-quinolin-1-yl)-(4-methyl-2-phenyl-1,3-oxazol-5-yl)methanone
CID 99811747
(2-ethyl-1,3-thiazol-5-yl)-(8-methoxy-3,4-dihydro-2H-quinolin-1-yl)methanone
CID 48575972
(4-aminophenyl)-(8-methoxy-3,4-dihydro-2H-quinolin-1-yl)methanone
CID 60951513
2,3-dihydroindol-1-yl-[5-[(4-iodophenoxy)methyl]furan-2-yl]methanone
CID 1017781
tert-butyl 4-[5-(phenoxymethyl)furan-2-carbonyl]piperazine-1-carboxylate
CID 46513396
(2-chlorofuran-3-yl)-(8-methoxy-3,4-dihydro-2H-quinolin-1-yl)methanone
CID 106686458
(8-methoxy-3,4-dihydro-2H-quinolin-1-yl)-(5-methyl-2-phenyltriazol-4-yl)methanone
CID 43066680

Frequently Asked Questions

What is the IUPAC name of (8-methoxy-3,4-dihydro-2H-quinolin-1-yl)-[5-(phenoxymethyl)furan-2-yl]methanone?
The IUPAC name of (8-methoxy-3,4-dihydro-2H-quinolin-1-yl)-[5-(phenoxymethyl)furan-2-yl]methanone (CID 43066677) is (8-methoxy-3,4-dihydro-2H-quinolin-1-yl)-[5-(phenoxymethyl)furan-2-yl]methanone.
What is the SMILES notation for (8-methoxy-3,4-dihydro-2H-quinolin-1-yl)-[5-(phenoxymethyl)furan-2-yl]methanone?
The canonical SMILES for (8-methoxy-3,4-dihydro-2H-quinolin-1-yl)-[5-(phenoxymethyl)furan-2-yl]methanone is COc1cccc2c1N(C(=O)c1ccc(COc3ccccc3)o1)CCC2.
What is the InChIKey of (8-methoxy-3,4-dihydro-2H-quinolin-1-yl)-[5-(phenoxymethyl)furan-2-yl]methanone?
The InChIKey is IAKJLSRHPVTKSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21NO4/c1-25-19-11-5-7-16-8-6-14-23(21(16)19)22(24)20-13-12-18(27-20)15-26-17-9-3-2-4-10-17/h2-5,7,9-13H,6,8,14-15H2,1H3.
What are the key properties of (8-methoxy-3,4-dihydro-2H-quinolin-1-yl)-[5-(phenoxymethyl)furan-2-yl]methanone?
(8-methoxy-3,4-dihydro-2H-quinolin-1-yl)-[5-(phenoxymethyl)furan-2-yl]methanone has a molecular weight of 363.41 g/mol, XLogP of 4.46, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (8-methoxy-3,4-dihydro-2H-quinolin-1-yl)-[5-(phenoxymethyl)furan-2-yl]methanone is sourced from PubChem (CID 43066677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).