2H-pyrido[3,2-f]quinazolin-1-one

C11H7N3O — CID 135776062

IUPAC2H-pyrido[3,2-f]quinazolin-1-one
SMILESO=c1[nH]cnc2ccc3ncccc3c12
InChIInChI=1S/C11H7N3O/c15-11-10-7-2-1-5-12-8(7)3-4-9(10)13-6-14-11/h1-6H,(H,13,14,15)
InChIKeySVLSFGIEVAECJB-UHFFFAOYSA-N
MW197.20 g/mol
LogP1.47
Rot. Bonds

About 2H-pyrido[3,2-f]quinazolin-1-one

2H-pyrido[3,2-f]quinazolin-1-one (PubChem CID 135776062) has the molecular formula C11H7N3O and a molecular weight of 197.20 g/mol. Its IUPAC name is 2H-pyrido[3,2-f]quinazolin-1-one.

Molecular Properties

Compound Name2H-pyrido[3,2-f]quinazolin-1-one
PubChem CID135776062
Molecular FormulaC11H7N3O
Molecular Weight197.20 g/mol
Exact Mass197.06
IUPAC Name2H-pyrido[3,2-f]quinazolin-1-one
SMILESO=c1[nH]cnc2ccc3ncccc3c12
InChIInChI=1S/C11H7N3O/c15-11-10-7-2-1-5-12-8(7)3-4-9(10)13-6-14-11/h1-6H,(H,13,14,15)
InChIKeySVLSFGIEVAECJB-UHFFFAOYSA-N
XLogP1.47
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.20
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2H-pyrido[3,2-f]quinazolin-1-one?
The IUPAC name of 2H-pyrido[3,2-f]quinazolin-1-one (CID 135776062) is 2H-pyrido[3,2-f]quinazolin-1-one.
What is the SMILES notation for 2H-pyrido[3,2-f]quinazolin-1-one?
The canonical SMILES for 2H-pyrido[3,2-f]quinazolin-1-one is O=c1[nH]cnc2ccc3ncccc3c12.
What is the InChIKey of 2H-pyrido[3,2-f]quinazolin-1-one?
The InChIKey is SVLSFGIEVAECJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7N3O/c15-11-10-7-2-1-5-12-8(7)3-4-9(10)13-6-14-11/h1-6H,(H,13,14,15).
What are the key properties of 2H-pyrido[3,2-f]quinazolin-1-one?
2H-pyrido[3,2-f]quinazolin-1-one has a molecular weight of 197.20 g/mol, XLogP of 1.47, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2H-pyrido[3,2-f]quinazolin-1-one is sourced from PubChem (CID 135776062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).