2-amino-7-fluoro-3H-quinazolin-4-one;vanadium

C8H6FN3OV — CID 160605565

IUPAC2-amino-7-fluoro-3H-quinazolin-4-one;vanadium
SMILESNc1nc2cc(F)ccc2c(=O)[nH]1.[V]
InChIInChI=1S/C8H6FN3O.V/c9-4-1-2-5-6(3-4)11-8(10)12-7(5)13;/h1-3H,(H3,10,11,12,13);
InChIKeyAVBBZNQCMQTUDD-UHFFFAOYSA-N
MW230.10 g/mol
LogP0.64
Rot. Bonds

About 2-amino-7-fluoro-3H-quinazolin-4-one;vanadium

2-amino-7-fluoro-3H-quinazolin-4-one;vanadium (PubChem CID 160605565) has the molecular formula C8H6FN3OV and a molecular weight of 230.10 g/mol. Its IUPAC name is 2-amino-7-fluoro-3H-quinazolin-4-one;vanadium.

Molecular Properties

Compound Name2-amino-7-fluoro-3H-quinazolin-4-one;vanadium
PubChem CID160605565
Molecular FormulaC8H6FN3OV
Molecular Weight230.10 g/mol
Exact Mass229.99
IUPAC Name2-amino-7-fluoro-3H-quinazolin-4-one;vanadium
SMILESNc1nc2cc(F)ccc2c(=O)[nH]1.[V]
InChIInChI=1S/C8H6FN3O.V/c9-4-1-2-5-6(3-4)11-8(10)12-7(5)13;/h1-3H,(H3,10,11,12,13);
InChIKeyAVBBZNQCMQTUDD-UHFFFAOYSA-N
XLogP0.64
TPSA71.77 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.10
LogP ≤ 50.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-amino-7-fluoro-3H-quinazolin-4-one;vanadium?
The IUPAC name of 2-amino-7-fluoro-3H-quinazolin-4-one;vanadium (CID 160605565) is 2-amino-7-fluoro-3H-quinazolin-4-one;vanadium.
What is the SMILES notation for 2-amino-7-fluoro-3H-quinazolin-4-one;vanadium?
The canonical SMILES for 2-amino-7-fluoro-3H-quinazolin-4-one;vanadium is Nc1nc2cc(F)ccc2c(=O)[nH]1.[V].
What is the InChIKey of 2-amino-7-fluoro-3H-quinazolin-4-one;vanadium?
The InChIKey is AVBBZNQCMQTUDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6FN3O.V/c9-4-1-2-5-6(3-4)11-8(10)12-7(5)13;/h1-3H,(H3,10,11,12,13);.
What are the key properties of 2-amino-7-fluoro-3H-quinazolin-4-one;vanadium?
2-amino-7-fluoro-3H-quinazolin-4-one;vanadium has a molecular weight of 230.10 g/mol, XLogP of 0.64, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-7-fluoro-3H-quinazolin-4-one;vanadium is sourced from PubChem (CID 160605565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).