2,3,7,10,11-pentamethoxy-5H-pyrido[2,3-f][1,7]phenanthrolin-6-one

C20H19N3O6 — CID 19043261

IUPAC2,3,7,10,11-pentamethoxy-5H-pyrido[2,3-f][1,7]phenanthrolin-6-one
SMILESCOc1cc2c(nc1OC)c1cc(OC)c(OC)nc1c1cc(OC)c(=O)[nH]c21
InChIInChI=1S/C20H19N3O6/c1-25-12-6-9-15(21-18(12)24)10-7-13(26-2)19(28-4)23-17(10)11-8-14(27-3)20(29-5)22-16(9)11/h6-8H,1-5H3,(H,21,24)
InChIKeyVWEGLBJFTMAIFD-UHFFFAOYSA-N
MW397.39 g/mol
LogP2.67
Rot. Bonds5

About 2,3,7,10,11-pentamethoxy-5H-pyrido[2,3-f][1,7]phenanthrolin-6-one

2,3,7,10,11-pentamethoxy-5H-pyrido[2,3-f][1,7]phenanthrolin-6-one (PubChem CID 19043261) has the molecular formula C20H19N3O6 and a molecular weight of 397.39 g/mol. Its IUPAC name is 2,3,7,10,11-pentamethoxy-5H-pyrido[2,3-f][1,7]phenanthrolin-6-one.

Molecular Properties

Compound Name2,3,7,10,11-pentamethoxy-5H-pyrido[2,3-f][1,7]phenanthrolin-6-one
PubChem CID19043261
Molecular FormulaC20H19N3O6
Molecular Weight397.39 g/mol
Exact Mass397.13
IUPAC Name2,3,7,10,11-pentamethoxy-5H-pyrido[2,3-f][1,7]phenanthrolin-6-one
SMILESCOc1cc2c(nc1OC)c1cc(OC)c(OC)nc1c1cc(OC)c(=O)[nH]c21
InChIInChI=1S/C20H19N3O6/c1-25-12-6-9-15(21-18(12)24)10-7-13(26-2)19(28-4)23-17(10)11-8-14(27-3)20(29-5)22-16(9)11/h6-8H,1-5H3,(H,21,24)
InChIKeyVWEGLBJFTMAIFD-UHFFFAOYSA-N
XLogP2.67
TPSA104.79 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500397.39
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze 2,3,7,10,11-pentamethoxy-5H-pyrido[2,3-f][1,7]phenanthrolin-6-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

8-iodo-3-methoxy-1H-quinolin-2-one
CID 68636812
3-methoxy-8-methyl-1H-quinolin-2-one
CID 151998755
8-ethyl-3-methoxy-1H-quinolin-2-one
CID 119083523
2,3-dimethoxy-7,10-dihydropyrazino[2,3-f]quinoxaline-8,9-dione
CID 72723728
3-methoxy-6,9-dimethyl-1H-1-benzazepine-2,5-dione
CID 10704674
2-bromo-6,7-dimethoxy-3H-quinazolin-4-one
CID 163409774
2,3-dimethoxy-6H-pyrido[3,4-b]pyrazin-5-one
CID 176774328
diaminomethylidene-(6,7-dimethoxy-4-oxo-3H-quinazolin-2-yl)azanium
CID 135449625
7-(4-fluoro-2-methyl-1H-indol-5-yl)-2,3-dimethoxy-1,7-naphthyridin-8-one
CID 175939008
6,7-dimethoxy-4-methyl-2H-isoquinolin-1-one
CID 167049433
1-(2,5,6-trimethoxy-3-pyridinyl)ethanone
CID 71300170
6-methoxy-3-azabicyclo[3.2.2]nona-1(7),5,8-triene-2,4-dione
CID 154365196

Frequently Asked Questions

What is the IUPAC name of 2,3,7,10,11-pentamethoxy-5H-pyrido[2,3-f][1,7]phenanthrolin-6-one?
The IUPAC name of 2,3,7,10,11-pentamethoxy-5H-pyrido[2,3-f][1,7]phenanthrolin-6-one (CID 19043261) is 2,3,7,10,11-pentamethoxy-5H-pyrido[2,3-f][1,7]phenanthrolin-6-one.
What is the SMILES notation for 2,3,7,10,11-pentamethoxy-5H-pyrido[2,3-f][1,7]phenanthrolin-6-one?
The canonical SMILES for 2,3,7,10,11-pentamethoxy-5H-pyrido[2,3-f][1,7]phenanthrolin-6-one is COc1cc2c(nc1OC)c1cc(OC)c(OC)nc1c1cc(OC)c(=O)[nH]c21.
What is the InChIKey of 2,3,7,10,11-pentamethoxy-5H-pyrido[2,3-f][1,7]phenanthrolin-6-one?
The InChIKey is VWEGLBJFTMAIFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O6/c1-25-12-6-9-15(21-18(12)24)10-7-13(26-2)19(28-4)23-17(10)11-8-14(27-3)20(29-5)22-16(9)11/h6-8H,1-5H3,(H,21,24).
What are the key properties of 2,3,7,10,11-pentamethoxy-5H-pyrido[2,3-f][1,7]phenanthrolin-6-one?
2,3,7,10,11-pentamethoxy-5H-pyrido[2,3-f][1,7]phenanthrolin-6-one has a molecular weight of 397.39 g/mol, XLogP of 2.67, 5 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,7,10,11-pentamethoxy-5H-pyrido[2,3-f][1,7]phenanthrolin-6-one is sourced from PubChem (CID 19043261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).