pyrido[3,4-g]quinazolin-2-amine

C11H8N4 — CID 118988440

IUPACpyrido[3,4-g]quinazolin-2-amine
SMILESNc1ncc2cc3cnccc3cc2n1
InChIInChI=1S/C11H8N4/c12-11-14-6-9-3-8-5-13-2-1-7(8)4-10(9)15-11/h1-6H,(H2,12,14,15)
InChIKeyHTMYPIWEXZOFDM-UHFFFAOYSA-N
MW196.21 g/mol
LogP1.76
Rot. Bonds

About pyrido[3,4-g]quinazolin-2-amine

pyrido[3,4-g]quinazolin-2-amine (PubChem CID 118988440) has the molecular formula C11H8N4 and a molecular weight of 196.21 g/mol. Its IUPAC name is pyrido[3,4-g]quinazolin-2-amine.

Molecular Properties

Compound Namepyrido[3,4-g]quinazolin-2-amine
PubChem CID118988440
Molecular FormulaC11H8N4
Molecular Weight196.21 g/mol
Exact Mass196.07
IUPAC Namepyrido[3,4-g]quinazolin-2-amine
SMILESNc1ncc2cc3cnccc3cc2n1
InChIInChI=1S/C11H8N4/c12-11-14-6-9-3-8-5-13-2-1-7(8)4-10(9)15-11/h1-6H,(H2,12,14,15)
InChIKeyHTMYPIWEXZOFDM-UHFFFAOYSA-N
XLogP1.76
TPSA64.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.21
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of pyrido[3,4-g]quinazolin-2-amine?
The IUPAC name of pyrido[3,4-g]quinazolin-2-amine (CID 118988440) is pyrido[3,4-g]quinazolin-2-amine.
What is the SMILES notation for pyrido[3,4-g]quinazolin-2-amine?
The canonical SMILES for pyrido[3,4-g]quinazolin-2-amine is Nc1ncc2cc3cnccc3cc2n1.
What is the InChIKey of pyrido[3,4-g]quinazolin-2-amine?
The InChIKey is HTMYPIWEXZOFDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8N4/c12-11-14-6-9-3-8-5-13-2-1-7(8)4-10(9)15-11/h1-6H,(H2,12,14,15).
What are the key properties of pyrido[3,4-g]quinazolin-2-amine?
pyrido[3,4-g]quinazolin-2-amine has a molecular weight of 196.21 g/mol, XLogP of 1.76, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for pyrido[3,4-g]quinazolin-2-amine is sourced from PubChem (CID 118988440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).