2,3-dimethoxy-9-methylquinolino[3,4-c]quinoline

C19H16N2O2 — CID 175795792

IUPAC2,3-dimethoxy-9-methylquinolino[3,4-c]quinoline
SMILESCOc1cc2ncc3cnc4c(C)cccc4c3c2cc1OC
InChIInChI=1S/C19H16N2O2/c1-11-5-4-6-13-18-12(10-21-19(11)13)9-20-15-8-17(23-3)16(22-2)7-14(15)18/h4-10H,1-3H3
InChIKeyYLKXKBAAEVFXRU-UHFFFAOYSA-N
MW304.35 g/mol
LogP4.26
Rot. Bonds2

About 2,3-dimethoxy-9-methylquinolino[3,4-c]quinoline

2,3-dimethoxy-9-methylquinolino[3,4-c]quinoline (PubChem CID 175795792) has the molecular formula C19H16N2O2 and a molecular weight of 304.35 g/mol. Its IUPAC name is 2,3-dimethoxy-9-methylquinolino[3,4-c]quinoline.

Molecular Properties

Compound Name2,3-dimethoxy-9-methylquinolino[3,4-c]quinoline
PubChem CID175795792
Molecular FormulaC19H16N2O2
Molecular Weight304.35 g/mol
Exact Mass304.12
IUPAC Name2,3-dimethoxy-9-methylquinolino[3,4-c]quinoline
SMILESCOc1cc2ncc3cnc4c(C)cccc4c3c2cc1OC
InChIInChI=1S/C19H16N2O2/c1-11-5-4-6-13-18-12(10-21-19(11)13)9-20-15-8-17(23-3)16(22-2)7-14(15)18/h4-10H,1-3H3
InChIKeyYLKXKBAAEVFXRU-UHFFFAOYSA-N
XLogP4.26
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.35
LogP ≤ 54.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2,3,10,11-tetramethoxy-8-methylbenzo[a]phenanthridine
CID 22296536
6,7-dimethoxy-4-(2-methylphenyl)quinazolin-2-amine
CID 70192475
7,8-dimethoxy-2-methyl-3H-imidazo[4,5-c]quinoline
CID 156713420
8,9-dimethoxy-6-methylphenanthridine
CID 135040288
5-methoxy-1,7-phenanthroline
CID 67576947
4-fluoro-9,10-dimethoxy-[1]benzothiolo[2,3-c]quinoline
CID 15737173
methane;4,6,7-trimethoxyquinoline
CID 157066291
10-methylphenanthridine
CID 101052009
5-methoxy-8-methylquinolin-3-ol
CID 130496401
6-methoxy-4-methylbenzo[h]quinoline
CID 11009579
2,3,6,7-tetramethoxy-9-methylacridine
CID 46187785
1-(3-chloro-4-methylphenyl)-7,8-dimethoxy-3H-pyrazolo[3,4-c]quinoline
CID 68631932

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethoxy-9-methylquinolino[3,4-c]quinoline?
The IUPAC name of 2,3-dimethoxy-9-methylquinolino[3,4-c]quinoline (CID 175795792) is 2,3-dimethoxy-9-methylquinolino[3,4-c]quinoline.
What is the SMILES notation for 2,3-dimethoxy-9-methylquinolino[3,4-c]quinoline?
The canonical SMILES for 2,3-dimethoxy-9-methylquinolino[3,4-c]quinoline is COc1cc2ncc3cnc4c(C)cccc4c3c2cc1OC.
What is the InChIKey of 2,3-dimethoxy-9-methylquinolino[3,4-c]quinoline?
The InChIKey is YLKXKBAAEVFXRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N2O2/c1-11-5-4-6-13-18-12(10-21-19(11)13)9-20-15-8-17(23-3)16(22-2)7-14(15)18/h4-10H,1-3H3.
What are the key properties of 2,3-dimethoxy-9-methylquinolino[3,4-c]quinoline?
2,3-dimethoxy-9-methylquinolino[3,4-c]quinoline has a molecular weight of 304.35 g/mol, XLogP of 4.26, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethoxy-9-methylquinolino[3,4-c]quinoline is sourced from PubChem (CID 175795792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).