4-(5-fluoro-2-methylphenoxy)quinazolin-2-amine

C15H12FN3O — CID 102989130

IUPAC4-(5-fluoro-2-methylphenoxy)quinazolin-2-amine
SMILESCc1ccc(F)cc1Oc1nc(N)nc2ccccc12
InChIInChI=1S/C15H12FN3O/c1-9-6-7-10(16)8-13(9)20-14-11-4-2-3-5-12(11)18-15(17)19-14/h2-8H,1H3,(H2,17,18,19)
InChIKeyOXAAKWZPWMLQQW-UHFFFAOYSA-N
MW269.28 g/mol
LogP3.45
Rot. Bonds2

About 4-(5-fluoro-2-methylphenoxy)quinazolin-2-amine

4-(5-fluoro-2-methylphenoxy)quinazolin-2-amine (PubChem CID 102989130) has the molecular formula C15H12FN3O and a molecular weight of 269.28 g/mol. Its IUPAC name is 4-(5-fluoro-2-methylphenoxy)quinazolin-2-amine.

Molecular Properties

Compound Name4-(5-fluoro-2-methylphenoxy)quinazolin-2-amine
PubChem CID102989130
Molecular FormulaC15H12FN3O
Molecular Weight269.28 g/mol
Exact Mass269.10
IUPAC Name4-(5-fluoro-2-methylphenoxy)quinazolin-2-amine
SMILESCc1ccc(F)cc1Oc1nc(N)nc2ccccc12
InChIInChI=1S/C15H12FN3O/c1-9-6-7-10(16)8-13(9)20-14-11-4-2-3-5-12(11)18-15(17)19-14/h2-8H,1H3,(H2,17,18,19)
InChIKeyOXAAKWZPWMLQQW-UHFFFAOYSA-N
XLogP3.45
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.28
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(2-methylphenoxy)quinazolin-2-amine
CID 80869397
4-(2-fluorophenoxy)quinazolin-2-amine
CID 80864583
4-(2-methoxy-4-methylphenoxy)quinazolin-2-amine
CID 80874331
4-(4-chloro-3-methylphenoxy)quinazolin-2-amine
CID 80865775
4-(2-bromo-4-methoxyphenoxy)quinazolin-2-amine
CID 104708851
4-fluoro-2-(2-methylquinolin-4-yl)oxyaniline
CID 43525450
4-(4-fluorophenoxy)-2-methylquinazoline
CID 101092876
4-(5-fluoro-2-methylphenoxy)-6-pyrazol-1-yl-1,3,5-triazin-2-amine
CID 102988931
4-(1,1,1-trifluoropropan-2-yloxy)quinazolin-2-amine
CID 80878281
4-(chloromethyl)-1-(5-fluoro-2-methylphenoxy)isoquinoline
CID 106769677
[4-(2-fluoro-5-methylphenoxy)quinazolin-2-yl]hydrazine
CID 80925069
6-(5-fluoro-2-methylphenoxy)-4-(trifluoromethyl)pyridin-2-amine
CID 102989067

Frequently Asked Questions

What is the IUPAC name of 4-(5-fluoro-2-methylphenoxy)quinazolin-2-amine?
The IUPAC name of 4-(5-fluoro-2-methylphenoxy)quinazolin-2-amine (CID 102989130) is 4-(5-fluoro-2-methylphenoxy)quinazolin-2-amine.
What is the SMILES notation for 4-(5-fluoro-2-methylphenoxy)quinazolin-2-amine?
The canonical SMILES for 4-(5-fluoro-2-methylphenoxy)quinazolin-2-amine is Cc1ccc(F)cc1Oc1nc(N)nc2ccccc12.
What is the InChIKey of 4-(5-fluoro-2-methylphenoxy)quinazolin-2-amine?
The InChIKey is OXAAKWZPWMLQQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12FN3O/c1-9-6-7-10(16)8-13(9)20-14-11-4-2-3-5-12(11)18-15(17)19-14/h2-8H,1H3,(H2,17,18,19).
What are the key properties of 4-(5-fluoro-2-methylphenoxy)quinazolin-2-amine?
4-(5-fluoro-2-methylphenoxy)quinazolin-2-amine has a molecular weight of 269.28 g/mol, XLogP of 3.45, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-fluoro-2-methylphenoxy)quinazolin-2-amine is sourced from PubChem (CID 102989130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).