4-fluoro-6-phenoxypyrimidin-2-amine

C10H8FN3O — CID 748216

IUPAC4-fluoro-6-phenoxypyrimidin-2-amine
SMILESNc1nc(F)cc(Oc2ccccc2)n1
InChIInChI=1S/C10H8FN3O/c11-8-6-9(14-10(12)13-8)15-7-4-2-1-3-5-7/h1-6H,(H2,12,13,14)
InChIKeyVAALKUKMPRWQEX-UHFFFAOYSA-N
MW205.19 g/mol
LogP1.99
Rot. Bonds2

About 4-fluoro-6-phenoxypyrimidin-2-amine

4-fluoro-6-phenoxypyrimidin-2-amine (PubChem CID 748216) has the molecular formula C10H8FN3O and a molecular weight of 205.19 g/mol. Its IUPAC name is 4-fluoro-6-phenoxypyrimidin-2-amine.

Molecular Properties

Compound Name4-fluoro-6-phenoxypyrimidin-2-amine
PubChem CID748216
Molecular FormulaC10H8FN3O
Molecular Weight205.19 g/mol
Exact Mass205.07
IUPAC Name4-fluoro-6-phenoxypyrimidin-2-amine
SMILESNc1nc(F)cc(Oc2ccccc2)n1
InChIInChI=1S/C10H8FN3O/c11-8-6-9(14-10(12)13-8)15-7-4-2-1-3-5-7/h1-6H,(H2,12,13,14)
InChIKeyVAALKUKMPRWQEX-UHFFFAOYSA-N
XLogP1.99
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.19
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-Methoxy-6-(2-prop-2-enylphenoxy)pyrimidine-2-ylamine
CID 686101
4-(2,5-Dimethylphenoxy)-6-fluoropyrimidin-2-amine
CID 695400
4-Chloro-6-(2-fluorophenoxy)pyrimidin-2-amine
CID 683987
4-Chloro-6-(3-methoxyphenoxy)pyrimidin-2-amine
CID 748222
Carbamic acid, N-(4,6-dimethoxy-2-pyrimidinyl)-, phenyl ester
CID 10945667
6-(Benzyloxy)pyrimidine-2,4-diamine
CID 10130617
4-N-methyl-6-phenoxypyrimidine-2,4-diamine
CID 80869080
4-Methoxy-6-phenoxypyrimidin-2-amine
CID 684938
2-Amino-4-(p-ethylphenoxy)-6-chloropyrimidine
CID 815741
4-(4-Ethylphenoxy)-6-methylpyrimidin-2-amine
CID 830665
2-[2-(2-Fluorophenoxy)ethylsulfanyl]pyrimidine-4,6-diamine
CID 1794610
[(4-Methyl-6-phenoxy-2-pyrimidinyl)oxy]acetonitrile
CID 1886522

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-6-phenoxypyrimidin-2-amine?
The IUPAC name of 4-fluoro-6-phenoxypyrimidin-2-amine (CID 748216) is 4-fluoro-6-phenoxypyrimidin-2-amine.
What is the SMILES notation for 4-fluoro-6-phenoxypyrimidin-2-amine?
The canonical SMILES for 4-fluoro-6-phenoxypyrimidin-2-amine is Nc1nc(F)cc(Oc2ccccc2)n1.
What is the InChIKey of 4-fluoro-6-phenoxypyrimidin-2-amine?
The InChIKey is VAALKUKMPRWQEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8FN3O/c11-8-6-9(14-10(12)13-8)15-7-4-2-1-3-5-7/h1-6H,(H2,12,13,14).
What are the key properties of 4-fluoro-6-phenoxypyrimidin-2-amine?
4-fluoro-6-phenoxypyrimidin-2-amine has a molecular weight of 205.19 g/mol, XLogP of 1.99, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-6-phenoxypyrimidin-2-amine is sourced from PubChem (CID 748216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).