2-(3-fluoro-4-methoxyphenyl)-6-methylquinazolin-4-amine

C16H14FN3O — CID 64983821

IUPAC2-(3-fluoro-4-methoxyphenyl)-6-methylquinazolin-4-amine
SMILESCOc1ccc(-c2nc(N)c3cc(C)ccc3n2)cc1F
InChIInChI=1S/C16H14FN3O/c1-9-3-5-13-11(7-9)15(18)20-16(19-13)10-4-6-14(21-2)12(17)8-10/h3-8H,1-2H3,(H2,18,19,20)
InChIKeyUZOIBLTXLMLKHH-UHFFFAOYSA-N
MW283.31 g/mol
LogP3.34
Rot. Bonds2

About 2-(3-fluoro-4-methoxyphenyl)-6-methylquinazolin-4-amine

2-(3-fluoro-4-methoxyphenyl)-6-methylquinazolin-4-amine (PubChem CID 64983821) has the molecular formula C16H14FN3O and a molecular weight of 283.31 g/mol. Its IUPAC name is 2-(3-fluoro-4-methoxyphenyl)-6-methylquinazolin-4-amine.

Molecular Properties

Compound Name2-(3-fluoro-4-methoxyphenyl)-6-methylquinazolin-4-amine
PubChem CID64983821
Molecular FormulaC16H14FN3O
Molecular Weight283.31 g/mol
Exact Mass283.11
IUPAC Name2-(3-fluoro-4-methoxyphenyl)-6-methylquinazolin-4-amine
SMILESCOc1ccc(-c2nc(N)c3cc(C)ccc3n2)cc1F
InChIInChI=1S/C16H14FN3O/c1-9-3-5-13-11(7-9)15(18)20-16(19-13)10-4-6-14(21-2)12(17)8-10/h3-8H,1-2H3,(H2,18,19,20)
InChIKeyUZOIBLTXLMLKHH-UHFFFAOYSA-N
XLogP3.34
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.31
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-fluoro-3-methylphenyl)-6-methylquinazolin-4-amine
CID 64983492
2-(4-methoxyphenyl)-6-methylquinazolin-4-amine
CID 64983774
7-chloro-2-(3-fluoro-4-methoxyphenyl)quinazolin-4-amine
CID 64983945
2-(3-fluoro-4-methoxyphenyl)-5,6-dimethylpyrimidin-4-amine
CID 65101012
2-(4-chloro-2-methoxyphenyl)-6-methylquinazolin-4-amine
CID 64983776
5-bromo-2-(3-fluoro-4-methoxyphenyl)-6-methylpyrimidin-4-amine
CID 66303209
2-(3-fluoro-4-methoxyphenyl)-6-methylquinoline-4-carboxylic acid
CID 3492969
3-(3-fluoro-4-methoxyphenyl)-5-methoxy-6-methylpyridin-2-amine
CID 157017577
5-bromo-2-(3-fluoro-4-methoxyphenyl)-6-propylpyrimidin-4-amine
CID 66295747
4-(3-fluoro-4-methoxyphenyl)-6-methylsulfanyl-1,3,5-triazin-2-amine
CID 83085161
6-chloro-2-(2-fluoro-5-methylphenyl)quinazolin-4-amine
CID 64983529
2-(2,5-dimethylphenyl)-6-methylquinazolin-4-amine
CID 64983731

Frequently Asked Questions

What is the IUPAC name of 2-(3-fluoro-4-methoxyphenyl)-6-methylquinazolin-4-amine?
The IUPAC name of 2-(3-fluoro-4-methoxyphenyl)-6-methylquinazolin-4-amine (CID 64983821) is 2-(3-fluoro-4-methoxyphenyl)-6-methylquinazolin-4-amine.
What is the SMILES notation for 2-(3-fluoro-4-methoxyphenyl)-6-methylquinazolin-4-amine?
The canonical SMILES for 2-(3-fluoro-4-methoxyphenyl)-6-methylquinazolin-4-amine is COc1ccc(-c2nc(N)c3cc(C)ccc3n2)cc1F.
What is the InChIKey of 2-(3-fluoro-4-methoxyphenyl)-6-methylquinazolin-4-amine?
The InChIKey is UZOIBLTXLMLKHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14FN3O/c1-9-3-5-13-11(7-9)15(18)20-16(19-13)10-4-6-14(21-2)12(17)8-10/h3-8H,1-2H3,(H2,18,19,20).
What are the key properties of 2-(3-fluoro-4-methoxyphenyl)-6-methylquinazolin-4-amine?
2-(3-fluoro-4-methoxyphenyl)-6-methylquinazolin-4-amine has a molecular weight of 283.31 g/mol, XLogP of 3.34, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluoro-4-methoxyphenyl)-6-methylquinazolin-4-amine is sourced from PubChem (CID 64983821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).