N-(4-fluorophenyl)-2-pyridin-4-ylquinazolin-4-amine

C19H13FN4 — CID 921587

IUPACN-(4-fluorophenyl)-2-pyridin-4-ylquinazolin-4-amine
SMILESFc1ccc(Nc2nc(-c3ccncc3)nc3ccccc23)cc1
InChIInChI=1S/C19H13FN4/c20-14-5-7-15(8-6-14)22-19-16-3-1-2-4-17(16)23-18(24-19)13-9-11-21-12-10-13/h1-12H,(H,22,23,24)
InChIKeyWVEZZMMWJAYZCN-UHFFFAOYSA-N
MW316.34 g/mol
LogP4.57
Rot. Bonds3

About N-(4-fluorophenyl)-2-pyridin-4-ylquinazolin-4-amine

N-(4-fluorophenyl)-2-pyridin-4-ylquinazolin-4-amine (PubChem CID 921587) has the molecular formula C19H13FN4 and a molecular weight of 316.34 g/mol. Its IUPAC name is N-(4-fluorophenyl)-2-pyridin-4-ylquinazolin-4-amine.

Molecular Properties

Compound NameN-(4-fluorophenyl)-2-pyridin-4-ylquinazolin-4-amine
PubChem CID921587
Molecular FormulaC19H13FN4
Molecular Weight316.34 g/mol
Exact Mass316.11
IUPAC NameN-(4-fluorophenyl)-2-pyridin-4-ylquinazolin-4-amine
SMILESFc1ccc(Nc2nc(-c3ccncc3)nc3ccccc23)cc1
InChIInChI=1S/C19H13FN4/c20-14-5-7-15(8-6-14)22-19-16-3-1-2-4-17(16)23-18(24-19)13-9-11-21-12-10-13/h1-12H,(H,22,23,24)
InChIKeyWVEZZMMWJAYZCN-UHFFFAOYSA-N
XLogP4.57
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.34
LogP ≤ 54.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-2-pyridin-4-ylquinazolin-4-amine?
The IUPAC name of N-(4-fluorophenyl)-2-pyridin-4-ylquinazolin-4-amine (CID 921587) is N-(4-fluorophenyl)-2-pyridin-4-ylquinazolin-4-amine.
What is the SMILES notation for N-(4-fluorophenyl)-2-pyridin-4-ylquinazolin-4-amine?
The canonical SMILES for N-(4-fluorophenyl)-2-pyridin-4-ylquinazolin-4-amine is Fc1ccc(Nc2nc(-c3ccncc3)nc3ccccc23)cc1.
What is the InChIKey of N-(4-fluorophenyl)-2-pyridin-4-ylquinazolin-4-amine?
The InChIKey is WVEZZMMWJAYZCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13FN4/c20-14-5-7-15(8-6-14)22-19-16-3-1-2-4-17(16)23-18(24-19)13-9-11-21-12-10-13/h1-12H,(H,22,23,24).
What are the key properties of N-(4-fluorophenyl)-2-pyridin-4-ylquinazolin-4-amine?
N-(4-fluorophenyl)-2-pyridin-4-ylquinazolin-4-amine has a molecular weight of 316.34 g/mol, XLogP of 4.57, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-2-pyridin-4-ylquinazolin-4-amine is sourced from PubChem (CID 921587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).