(4-methoxyphenyl)-(1,2,3,4-tetrahydroacridin-9-yl)methanone

C21H19NO2 — CID 21239887

IUPAC(4-methoxyphenyl)-(1,2,3,4-tetrahydroacridin-9-yl)methanone
SMILESCOc1ccc(C(=O)c2c3c(nc4ccccc24)CCCC3)cc1
InChIInChI=1S/C21H19NO2/c1-24-15-12-10-14(11-13-15)21(23)20-16-6-2-4-8-18(16)22-19-9-5-3-7-17(19)20/h2,4,6,8,10-13H,3,5,7,9H2,1H3
InChIKeyQJUXKNCYQVSVOX-UHFFFAOYSA-N
MW317.39 g/mol
LogP4.35
Rot. Bonds3

About (4-methoxyphenyl)-(1,2,3,4-tetrahydroacridin-9-yl)methanone

(4-methoxyphenyl)-(1,2,3,4-tetrahydroacridin-9-yl)methanone (PubChem CID 21239887) has the molecular formula C21H19NO2 and a molecular weight of 317.39 g/mol. Its IUPAC name is (4-methoxyphenyl)-(1,2,3,4-tetrahydroacridin-9-yl)methanone.

Molecular Properties

Compound Name(4-methoxyphenyl)-(1,2,3,4-tetrahydroacridin-9-yl)methanone
PubChem CID21239887
Molecular FormulaC21H19NO2
Molecular Weight317.39 g/mol
Exact Mass317.14
IUPAC Name(4-methoxyphenyl)-(1,2,3,4-tetrahydroacridin-9-yl)methanone
SMILESCOc1ccc(C(=O)c2c3c(nc4ccccc24)CCCC3)cc1
InChIInChI=1S/C21H19NO2/c1-24-15-12-10-14(11-13-15)21(23)20-16-6-2-4-8-18(16)22-19-9-5-3-7-17(19)20/h2,4,6,8,10-13H,3,5,7,9H2,1H3
InChIKeyQJUXKNCYQVSVOX-UHFFFAOYSA-N
XLogP4.35
TPSA39.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.39
LogP ≤ 54.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(4-methoxyphenyl)methyl 2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxylate
CID 16578464
2-(4-methoxyphenyl)ethyl 2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxylate
CID 7839905
1,2,3,4-tetrahydroacridine-9-carboxylic acid;hydrate
CID 16667447
(3-methylphenyl)-(1,2,3,4-tetrahydroacridin-9-yl)methanone
CID 21239885
N-(2,4-dimethoxyphenyl)-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxamide
CID 862181
(2,5-dimethylphenyl)-(1,2,3,4-tetrahydroacridin-9-yl)methanone
CID 21239890
methyl 4-(1,2,3,4-tetrahydroacridine-9-carbonylamino)benzoate
CID 9247815
N-(3-methoxyphenyl)-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxamide
CID 862180
[2-(3-methoxyphenyl)-2-oxoethyl] 1,2,3,4-tetrahydroacridine-9-carboxylate
CID 2146251
(4-carbamoylphenyl) 2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxylate
CID 75401713
[2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxoethyl] 1,2,3,4-tetrahydroacridine-9-carboxylate
CID 2672640
[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]methyl 1,2,3,4-tetrahydroacridine-9-carboxylate
CID 24530725

Frequently Asked Questions

What is the IUPAC name of (4-methoxyphenyl)-(1,2,3,4-tetrahydroacridin-9-yl)methanone?
The IUPAC name of (4-methoxyphenyl)-(1,2,3,4-tetrahydroacridin-9-yl)methanone (CID 21239887) is (4-methoxyphenyl)-(1,2,3,4-tetrahydroacridin-9-yl)methanone.
What is the SMILES notation for (4-methoxyphenyl)-(1,2,3,4-tetrahydroacridin-9-yl)methanone?
The canonical SMILES for (4-methoxyphenyl)-(1,2,3,4-tetrahydroacridin-9-yl)methanone is COc1ccc(C(=O)c2c3c(nc4ccccc24)CCCC3)cc1.
What is the InChIKey of (4-methoxyphenyl)-(1,2,3,4-tetrahydroacridin-9-yl)methanone?
The InChIKey is QJUXKNCYQVSVOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19NO2/c1-24-15-12-10-14(11-13-15)21(23)20-16-6-2-4-8-18(16)22-19-9-5-3-7-17(19)20/h2,4,6,8,10-13H,3,5,7,9H2,1H3.
What are the key properties of (4-methoxyphenyl)-(1,2,3,4-tetrahydroacridin-9-yl)methanone?
(4-methoxyphenyl)-(1,2,3,4-tetrahydroacridin-9-yl)methanone has a molecular weight of 317.39 g/mol, XLogP of 4.35, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methoxyphenyl)-(1,2,3,4-tetrahydroacridin-9-yl)methanone is sourced from PubChem (CID 21239887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).