4-(2-fluoro-4-methoxyphenyl)pyrimidin-2-amine

C11H10FN3O — CID 115505211

IUPAC4-(2-fluoro-4-methoxyphenyl)pyrimidin-2-amine
SMILESCOc1ccc(-c2ccnc(N)n2)c(F)c1
InChIInChI=1S/C11H10FN3O/c1-16-7-2-3-8(9(12)6-7)10-4-5-14-11(13)15-10/h2-6H,1H3,(H2,13,14,15)
InChIKeyRKAQKAJMGJZZJP-UHFFFAOYSA-N
MW219.22 g/mol
LogP1.87
Rot. Bonds2

About 4-(2-fluoro-4-methoxyphenyl)pyrimidin-2-amine

4-(2-fluoro-4-methoxyphenyl)pyrimidin-2-amine (PubChem CID 115505211) has the molecular formula C11H10FN3O and a molecular weight of 219.22 g/mol. Its IUPAC name is 4-(2-fluoro-4-methoxyphenyl)pyrimidin-2-amine.

Molecular Properties

Compound Name4-(2-fluoro-4-methoxyphenyl)pyrimidin-2-amine
PubChem CID115505211
Molecular FormulaC11H10FN3O
Molecular Weight219.22 g/mol
Exact Mass219.08
IUPAC Name4-(2-fluoro-4-methoxyphenyl)pyrimidin-2-amine
SMILESCOc1ccc(-c2ccnc(N)n2)c(F)c1
InChIInChI=1S/C11H10FN3O/c1-16-7-2-3-8(9(12)6-7)10-4-5-14-11(13)15-10/h2-6H,1H3,(H2,13,14,15)
InChIKeyRKAQKAJMGJZZJP-UHFFFAOYSA-N
XLogP1.87
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 ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(2,4-dimethoxyphenyl)pyrimidin-2-amine
CID 39733899
2-(2-fluoro-4-methoxyphenyl)-4-methylpyridin-3-amine
CID 114051155
4-(2-fluoro-3-methoxyphenyl)pyrimidin-2-amine
CID 82812333
5-fluoro-2-(2-fluoro-4-methoxyphenyl)pyridine
CID 70819002
5-(2-fluoro-4-methoxyphenyl)-1,2,4-thiadiazol-3-amine
CID 102885475
4-(2-fluoro-4-methoxyphenyl)-6-methylsulfanyl-1,3,5-triazin-2-amine
CID 102882416
4-(2,4-dimethoxyphenyl)-2-(3-fluoro-4-methoxyphenyl)pyrimidine
CID 175424034
3-(2-fluoro-4-methoxyphenyl)-2-methylpyridine
CID 118448916
4-(6-methoxy-9H-pyrido[3,4-b]indol-1-yl)pyrimidin-2-amine
CID 5257255
4-(2,4-dichlorophenyl)pyrimidin-2-amine
CID 4773592
6-(2-fluoro-4-methoxyphenyl)-1H-pyrimidine-2-thione
CID 106520926
4-(2,4-dimethoxy-6-methylphenyl)pyrimidin-2-amine
CID 116900504

Frequently Asked Questions

What is the IUPAC name of 4-(2-fluoro-4-methoxyphenyl)pyrimidin-2-amine?
The IUPAC name of 4-(2-fluoro-4-methoxyphenyl)pyrimidin-2-amine (CID 115505211) is 4-(2-fluoro-4-methoxyphenyl)pyrimidin-2-amine.
What is the SMILES notation for 4-(2-fluoro-4-methoxyphenyl)pyrimidin-2-amine?
The canonical SMILES for 4-(2-fluoro-4-methoxyphenyl)pyrimidin-2-amine is COc1ccc(-c2ccnc(N)n2)c(F)c1.
What is the InChIKey of 4-(2-fluoro-4-methoxyphenyl)pyrimidin-2-amine?
The InChIKey is RKAQKAJMGJZZJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10FN3O/c1-16-7-2-3-8(9(12)6-7)10-4-5-14-11(13)15-10/h2-6H,1H3,(H2,13,14,15).
What are the key properties of 4-(2-fluoro-4-methoxyphenyl)pyrimidin-2-amine?
4-(2-fluoro-4-methoxyphenyl)pyrimidin-2-amine has a molecular weight of 219.22 g/mol, XLogP of 1.87, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-fluoro-4-methoxyphenyl)pyrimidin-2-amine is sourced from PubChem (CID 115505211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).