7-fluoro-4-(1H-pyrazol-5-yl)quinazolin-2-amine

C11H8FN5 — CID 105486316

IUPAC7-fluoro-4-(1H-pyrazol-5-yl)quinazolin-2-amine
SMILESNc1nc(-c2ccn[nH]2)c2ccc(F)cc2n1
InChIInChI=1S/C11H8FN5/c12-6-1-2-7-9(5-6)15-11(13)16-10(7)8-3-4-14-17-8/h1-5H,(H,14,17)(H2,13,15,16)
InChIKeyRZYRBQGPPRVDBJ-UHFFFAOYSA-N
MW229.22 g/mol
LogP1.74
Rot. Bonds1

About 7-fluoro-4-(1H-pyrazol-5-yl)quinazolin-2-amine

7-fluoro-4-(1H-pyrazol-5-yl)quinazolin-2-amine (PubChem CID 105486316) has the molecular formula C11H8FN5 and a molecular weight of 229.22 g/mol. Its IUPAC name is 7-fluoro-4-(1H-pyrazol-5-yl)quinazolin-2-amine.

Molecular Properties

Compound Name7-fluoro-4-(1H-pyrazol-5-yl)quinazolin-2-amine
PubChem CID105486316
Molecular FormulaC11H8FN5
Molecular Weight229.22 g/mol
Exact Mass229.08
IUPAC Name7-fluoro-4-(1H-pyrazol-5-yl)quinazolin-2-amine
SMILESNc1nc(-c2ccn[nH]2)c2ccc(F)cc2n1
InChIInChI=1S/C11H8FN5/c12-6-1-2-7-9(5-6)15-11(13)16-10(7)8-3-4-14-17-8/h1-5H,(H,14,17)(H2,13,15,16)
InChIKeyRZYRBQGPPRVDBJ-UHFFFAOYSA-N
XLogP1.74
TPSA80.48 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.22
LogP ≤ 51.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 7-fluoro-4-(1H-pyrazol-5-yl)quinazolin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 7-fluoro-4-(1H-pyrazol-5-yl)quinazolin-2-amine?
The IUPAC name of 7-fluoro-4-(1H-pyrazol-5-yl)quinazolin-2-amine (CID 105486316) is 7-fluoro-4-(1H-pyrazol-5-yl)quinazolin-2-amine.
What is the SMILES notation for 7-fluoro-4-(1H-pyrazol-5-yl)quinazolin-2-amine?
The canonical SMILES for 7-fluoro-4-(1H-pyrazol-5-yl)quinazolin-2-amine is Nc1nc(-c2ccn[nH]2)c2ccc(F)cc2n1.
What is the InChIKey of 7-fluoro-4-(1H-pyrazol-5-yl)quinazolin-2-amine?
The InChIKey is RZYRBQGPPRVDBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8FN5/c12-6-1-2-7-9(5-6)15-11(13)16-10(7)8-3-4-14-17-8/h1-5H,(H,14,17)(H2,13,15,16).
What are the key properties of 7-fluoro-4-(1H-pyrazol-5-yl)quinazolin-2-amine?
7-fluoro-4-(1H-pyrazol-5-yl)quinazolin-2-amine has a molecular weight of 229.22 g/mol, XLogP of 1.74, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-4-(1H-pyrazol-5-yl)quinazolin-2-amine is sourced from PubChem (CID 105486316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).