2-[4-(6-amino-5-ethylpyrimidin-4-yl)oxyphenyl]ethanol

C14H17N3O2 — CID 107710167

IUPAC2-[4-(6-amino-5-ethylpyrimidin-4-yl)oxyphenyl]ethanol
SMILESCCc1c(N)ncnc1Oc1ccc(CCO)cc1
InChIInChI=1S/C14H17N3O2/c1-2-12-13(15)16-9-17-14(12)19-11-5-3-10(4-6-11)7-8-18/h3-6,9,18H,2,7-8H2,1H3,(H2,15,16,17)
InChIKeyZUHGBLINEYVVAT-UHFFFAOYSA-N
MW259.31 g/mol
LogP1.95
Rot. Bonds5

About 2-[4-(6-amino-5-ethylpyrimidin-4-yl)oxyphenyl]ethanol

2-[4-(6-amino-5-ethylpyrimidin-4-yl)oxyphenyl]ethanol (PubChem CID 107710167) has the molecular formula C14H17N3O2 and a molecular weight of 259.31 g/mol. Its IUPAC name is 2-[4-(6-amino-5-ethylpyrimidin-4-yl)oxyphenyl]ethanol.

Molecular Properties

Compound Name2-[4-(6-amino-5-ethylpyrimidin-4-yl)oxyphenyl]ethanol
PubChem CID107710167
Molecular FormulaC14H17N3O2
Molecular Weight259.31 g/mol
Exact Mass259.13
IUPAC Name2-[4-(6-amino-5-ethylpyrimidin-4-yl)oxyphenyl]ethanol
SMILESCCc1c(N)ncnc1Oc1ccc(CCO)cc1
InChIInChI=1S/C14H17N3O2/c1-2-12-13(15)16-9-17-14(12)19-11-5-3-10(4-6-11)7-8-18/h3-6,9,18H,2,7-8H2,1H3,(H2,15,16,17)
InChIKeyZUHGBLINEYVVAT-UHFFFAOYSA-N
XLogP1.95
TPSA81.26 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 51.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-propyl-6-(4-propylphenoxy)pyrimidin-4-amine
CID 80880474
2-[4-(5-amino-6-ethoxypyrimidin-4-yl)oxyphenyl]ethanol
CID 107708420
2-[4-(6-hydrazinyl-5-propylpyrimidin-4-yl)oxyphenyl]ethanol
CID 107710356
[3-(6-amino-5-ethylpyrimidin-4-yl)oxyphenyl]methanol
CID 80872602
4-chloro-5-ethyl-6-(4-propylphenoxy)pyrimidine
CID 55228714
6-(4-bromophenoxy)-5-propylpyrimidin-4-amine
CID 80864434
N,5-diethyl-6-(4-propylphenoxy)pyrimidin-4-amine
CID 80879453
[4-(6-amino-5-ethylpyrimidin-4-yl)oxy-3-methoxyphenyl]methanol
CID 107745155
5-ethyl-N-methyl-6-(4-propylphenoxy)pyrimidin-4-amine
CID 80880121
5-ethyl-6-(3-methoxyphenoxy)pyrimidin-4-amine
CID 80863933
4-(4-ethylphenoxy)-6-(4-methoxyphenoxy)pyrimidin-5-amine
CID 19154279
5-ethyl-6-[4-fluoro-3-(trifluoromethyl)phenoxy]pyrimidin-4-amine
CID 102747880

Frequently Asked Questions

What is the IUPAC name of 2-[4-(6-amino-5-ethylpyrimidin-4-yl)oxyphenyl]ethanol?
The IUPAC name of 2-[4-(6-amino-5-ethylpyrimidin-4-yl)oxyphenyl]ethanol (CID 107710167) is 2-[4-(6-amino-5-ethylpyrimidin-4-yl)oxyphenyl]ethanol.
What is the SMILES notation for 2-[4-(6-amino-5-ethylpyrimidin-4-yl)oxyphenyl]ethanol?
The canonical SMILES for 2-[4-(6-amino-5-ethylpyrimidin-4-yl)oxyphenyl]ethanol is CCc1c(N)ncnc1Oc1ccc(CCO)cc1.
What is the InChIKey of 2-[4-(6-amino-5-ethylpyrimidin-4-yl)oxyphenyl]ethanol?
The InChIKey is ZUHGBLINEYVVAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2/c1-2-12-13(15)16-9-17-14(12)19-11-5-3-10(4-6-11)7-8-18/h3-6,9,18H,2,7-8H2,1H3,(H2,15,16,17).
What are the key properties of 2-[4-(6-amino-5-ethylpyrimidin-4-yl)oxyphenyl]ethanol?
2-[4-(6-amino-5-ethylpyrimidin-4-yl)oxyphenyl]ethanol has a molecular weight of 259.31 g/mol, XLogP of 1.95, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(6-amino-5-ethylpyrimidin-4-yl)oxyphenyl]ethanol is sourced from PubChem (CID 107710167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).