6-(2-fluorophenoxy)-5-methylpyrimidin-4-amine

C11H10FN3O — CID 80864729

IUPAC6-(2-fluorophenoxy)-5-methylpyrimidin-4-amine
SMILESCc1c(N)ncnc1Oc1ccccc1F
InChIInChI=1S/C11H10FN3O/c1-7-10(13)14-6-15-11(7)16-9-5-3-2-4-8(9)12/h2-6H,1H3,(H2,13,14,15)
InChIKeyNRGOOGUCHHDTET-UHFFFAOYSA-N
MW219.22 g/mol
LogP2.30
Rot. Bonds2

About 6-(2-fluorophenoxy)-5-methylpyrimidin-4-amine

6-(2-fluorophenoxy)-5-methylpyrimidin-4-amine (PubChem CID 80864729) has the molecular formula C11H10FN3O and a molecular weight of 219.22 g/mol. Its IUPAC name is 6-(2-fluorophenoxy)-5-methylpyrimidin-4-amine.

Molecular Properties

Compound Name6-(2-fluorophenoxy)-5-methylpyrimidin-4-amine
PubChem CID80864729
Molecular FormulaC11H10FN3O
Molecular Weight219.22 g/mol
Exact Mass219.08
IUPAC Name6-(2-fluorophenoxy)-5-methylpyrimidin-4-amine
SMILESCc1c(N)ncnc1Oc1ccccc1F
InChIInChI=1S/C11H10FN3O/c1-7-10(13)14-6-15-11(7)16-9-5-3-2-4-8(9)12/h2-6H,1H3,(H2,13,14,15)
InChIKeyNRGOOGUCHHDTET-UHFFFAOYSA-N
XLogP2.30
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.22
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-(3-chloro-2-fluorophenoxy)-5-methylpyrimidin-4-amine
CID 116691260
6-(2,3-dimethylphenoxy)-5-methylpyrimidin-4-amine
CID 80863928
5-methyl-6-(2-nitrophenoxy)pyrimidin-4-amine
CID 80875420
4-(2-fluorophenoxy)pyrimidin-5-amine
CID 79917585
6-(4-chloro-3-fluorophenoxy)-5-methylpyrimidin-4-amine
CID 82719264
5-methyl-6-(4-methylsulfanylphenoxy)pyrimidin-4-amine
CID 80879504
5-methyl-6-(2-methyl-3-nitrophenoxy)pyrimidin-4-amine
CID 80875823
6-(4-methoxyphenoxy)-5-methylpyrimidin-4-amine
CID 80870116
6-(2-fluorophenyl)sulfanyl-5-methylpyrimidin-4-amine
CID 80884520
5-bromo-6-(2,4-difluorophenoxy)pyrimidin-4-amine
CID 114073133
6-(5-chloro-2-nitrophenoxy)-5-methylpyrimidin-4-amine
CID 80873761
[6-(2,5-difluorophenoxy)-5-methylpyrimidin-4-yl]hydrazine
CID 80924404

Frequently Asked Questions

What is the IUPAC name of 6-(2-fluorophenoxy)-5-methylpyrimidin-4-amine?
The IUPAC name of 6-(2-fluorophenoxy)-5-methylpyrimidin-4-amine (CID 80864729) is 6-(2-fluorophenoxy)-5-methylpyrimidin-4-amine.
What is the SMILES notation for 6-(2-fluorophenoxy)-5-methylpyrimidin-4-amine?
The canonical SMILES for 6-(2-fluorophenoxy)-5-methylpyrimidin-4-amine is Cc1c(N)ncnc1Oc1ccccc1F.
What is the InChIKey of 6-(2-fluorophenoxy)-5-methylpyrimidin-4-amine?
The InChIKey is NRGOOGUCHHDTET-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10FN3O/c1-7-10(13)14-6-15-11(7)16-9-5-3-2-4-8(9)12/h2-6H,1H3,(H2,13,14,15).
What are the key properties of 6-(2-fluorophenoxy)-5-methylpyrimidin-4-amine?
6-(2-fluorophenoxy)-5-methylpyrimidin-4-amine has a molecular weight of 219.22 g/mol, XLogP of 2.30, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-fluorophenoxy)-5-methylpyrimidin-4-amine is sourced from PubChem (CID 80864729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).