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

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Related Compounds

Pyrazolo[1,5-b]pyridazine deriv. 35
CID 6539377
N-1H-indazol-5-yl-2-(6-methylpyridin-2-yl)quinazolin-4-amine
CID 9998128
Pyrazolo[1,5-b]pyridazine deriv. 28
CID 6539370
N-(5-tert-butyl-1H-pyrazol-3-yl)-8-fluoro-2-[(2R)-2-methylpiperazin-1-yl]quinazolin-4-amine
CID 137552747
4,6-dimethyl-2-{(2E)-2-[(3-phenyl-1H-pyrazol-4-yl)methylidene]hydrazinyl}pyrimidine
CID 135654413
Pyrazolo[1,5-b]pyridazine deriv. 18
CID 6539450
6-(2-Aminopyrimidin-4-Yl)-1h-Indazol-3-Amine
CID 46215814
2-phenyl-N-(1H-pyrazol-5-yl)quinazolin-4-amine
CID 9814443
3-[(2-fluorophenyl)methyl]-7-(1H-pyrazol-5-yl)triazolo[4,5-d]pyrimidin-5-amine
CID 9836304
N-(5-methyl-1H-pyrazol-3-yl)-2-(pyridin-4-yl)quinazolin-4-amine
CID 9901007
2-N-[(4-fluorophenyl)methyl]-4-N-(5-methyl-1H-pyrazol-3-yl)quinazoline-2,4-diamine
CID 9924438
4-N-(5-methyl-1H-pyrazol-3-yl)-2-N-(pyridin-3-ylmethyl)quinazoline-2,4-diamine
CID 9945436

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).