5-methylquinolino[2,1-b]quinazolin-12-one

C17H12N2O — CID 14666352

IUPAC5-methylquinolino[2,1-b]quinazolin-12-one
SMILESCc1cc2nc3ccccc3c(=O)n2c2ccccc12
InChIInChI=1S/C17H12N2O/c1-11-10-16-18-14-8-4-2-7-13(14)17(20)19(16)15-9-5-3-6-12(11)15/h2-10H,1H3
InChIKeyIKBIIAPNIZQEMK-UHFFFAOYSA-N
MW260.30 g/mol
LogP3.31
Rot. Bonds

About 5-methylquinolino[2,1-b]quinazolin-12-one

5-methylquinolino[2,1-b]quinazolin-12-one (PubChem CID 14666352) has the molecular formula C17H12N2O and a molecular weight of 260.30 g/mol. Its IUPAC name is 5-methylquinolino[2,1-b]quinazolin-12-one.

Molecular Properties

Compound Name5-methylquinolino[2,1-b]quinazolin-12-one
PubChem CID14666352
Molecular FormulaC17H12N2O
Molecular Weight260.30 g/mol
Exact Mass260.09
IUPAC Name5-methylquinolino[2,1-b]quinazolin-12-one
SMILESCc1cc2nc3ccccc3c(=O)n2c2ccccc12
InChIInChI=1S/C17H12N2O/c1-11-10-16-18-14-8-4-2-7-13(14)17(20)19(16)15-9-5-3-6-12(11)15/h2-10H,1H3
InChIKeyIKBIIAPNIZQEMK-UHFFFAOYSA-N
XLogP3.31
TPSA34.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.30
LogP ≤ 53.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

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Related Compounds

9-methylpyrido[2,1-b]quinazolin-11-one
CID 11321767
3-[(5-methyl-[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanylmethyl]-1,2,3-benzotriazin-4-one
CID 2613181
5-methyl-1-phenyl-[1,2,4]triazolo[4,3-a]quinoline
CID 14666362
5-anilinoquinazolino[2,1-b]quinazolin-12-one
CID 11393590
3-bromoquinazolino[3,2-f]phenanthridin-14-one
CID 164913573
5-[2-(dimethylamino)ethylamino]quinazolino[2,1-b]quinazolin-12-one
CID 134096041
3-(9-phenylcarbazol-3-yl)quinazolino[3,2-f]phenanthridin-14-one
CID 164913455
ethane;5H-quinoxalino[2,1-b]quinazoline-6,12-dione
CID 156863175
5,8,9-trimethylbenzimidazolo[2,1-b]quinazolin-12-one
CID 102452373
5-methylimidazo[1,2-a]quinoline-2-carbaldehyde
CID 115026842
3-[3,5-bis(4-oxo-2-phenylquinazolin-3-yl)phenyl]-2-phenylquinazolin-4-one
CID 121247436
6-(3-chlorophenyl)quinazolino[2,1-b]quinazoline-5,12-dione
CID 156863089

Frequently Asked Questions

What is the IUPAC name of 5-methylquinolino[2,1-b]quinazolin-12-one?
The IUPAC name of 5-methylquinolino[2,1-b]quinazolin-12-one (CID 14666352) is 5-methylquinolino[2,1-b]quinazolin-12-one.
What is the SMILES notation for 5-methylquinolino[2,1-b]quinazolin-12-one?
The canonical SMILES for 5-methylquinolino[2,1-b]quinazolin-12-one is Cc1cc2nc3ccccc3c(=O)n2c2ccccc12.
What is the InChIKey of 5-methylquinolino[2,1-b]quinazolin-12-one?
The InChIKey is IKBIIAPNIZQEMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12N2O/c1-11-10-16-18-14-8-4-2-7-13(14)17(20)19(16)15-9-5-3-6-12(11)15/h2-10H,1H3.
What are the key properties of 5-methylquinolino[2,1-b]quinazolin-12-one?
5-methylquinolino[2,1-b]quinazolin-12-one has a molecular weight of 260.30 g/mol, XLogP of 3.31, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methylquinolino[2,1-b]quinazolin-12-one is sourced from PubChem (CID 14666352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).