[3-(6-aminopyrimidin-4-yl)oxyphenyl]methanol

C11H11N3O2 — CID 80873838

IUPAC[3-(6-aminopyrimidin-4-yl)oxyphenyl]methanol
SMILESNc1cc(Oc2cccc(CO)c2)ncn1
InChIInChI=1S/C11H11N3O2/c12-10-5-11(14-7-13-10)16-9-3-1-2-8(4-9)6-15/h1-5,7,15H,6H2,(H2,12,13,14)
InChIKeyYFOUKVRDUARJIH-UHFFFAOYSA-N
MW217.23 g/mol
LogP1.34
Rot. Bonds3

About [3-(6-aminopyrimidin-4-yl)oxyphenyl]methanol

[3-(6-aminopyrimidin-4-yl)oxyphenyl]methanol (PubChem CID 80873838) has the molecular formula C11H11N3O2 and a molecular weight of 217.23 g/mol. Its IUPAC name is [3-(6-aminopyrimidin-4-yl)oxyphenyl]methanol.

Molecular Properties

Compound Name[3-(6-aminopyrimidin-4-yl)oxyphenyl]methanol
PubChem CID80873838
Molecular FormulaC11H11N3O2
Molecular Weight217.23 g/mol
Exact Mass217.09
IUPAC Name[3-(6-aminopyrimidin-4-yl)oxyphenyl]methanol
SMILESNc1cc(Oc2cccc(CO)c2)ncn1
InChIInChI=1S/C11H11N3O2/c12-10-5-11(14-7-13-10)16-9-3-1-2-8(4-9)6-15/h1-5,7,15H,6H2,(H2,12,13,14)
InChIKeyYFOUKVRDUARJIH-UHFFFAOYSA-N
XLogP1.34
TPSA81.26 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.23
LogP ≤ 51.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

[3-(6-fluoropyrimidin-4-yl)oxyphenyl]methanol
CID 115416170
[3-(6-hydrazinylpyrimidin-4-yl)oxyphenyl]methanol
CID 80931261
6-(3-chlorophenoxy)pyrimidin-4-amine
CID 80869440
[3-(6-amino-2-methylsulfanylpyrimidin-4-yl)oxyphenyl]methanol
CID 80872360
6-[(3-methoxyphenyl)methoxy]pyrimidin-4-amine
CID 80868695
[3-(6-amino-5-ethylpyrimidin-4-yl)oxyphenyl]methanol
CID 80872602
[3-[(5-bromo-4-methyl-2-pyridinyl)oxy]phenyl]methanol
CID 114869670
[6-(3-aminophenoxy)-3-pyridinyl]methanol
CID 89089280
[3-[(4-nitro-2-pyridinyl)oxy]phenyl]methanol
CID 79869655
[3-(1-methylpyrazolo[5,4-d]pyrimidin-4-yl)oxyphenyl]methanol
CID 79868827
[3-(3-fluorophenoxy)phenyl]methanol
CID 13255235
[3-(8-aminoquinolin-4-yl)oxyphenyl]methanol
CID 83060557

Frequently Asked Questions

What is the IUPAC name of [3-(6-aminopyrimidin-4-yl)oxyphenyl]methanol?
The IUPAC name of [3-(6-aminopyrimidin-4-yl)oxyphenyl]methanol (CID 80873838) is [3-(6-aminopyrimidin-4-yl)oxyphenyl]methanol.
What is the SMILES notation for [3-(6-aminopyrimidin-4-yl)oxyphenyl]methanol?
The canonical SMILES for [3-(6-aminopyrimidin-4-yl)oxyphenyl]methanol is Nc1cc(Oc2cccc(CO)c2)ncn1.
What is the InChIKey of [3-(6-aminopyrimidin-4-yl)oxyphenyl]methanol?
The InChIKey is YFOUKVRDUARJIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N3O2/c12-10-5-11(14-7-13-10)16-9-3-1-2-8(4-9)6-15/h1-5,7,15H,6H2,(H2,12,13,14).
What are the key properties of [3-(6-aminopyrimidin-4-yl)oxyphenyl]methanol?
[3-(6-aminopyrimidin-4-yl)oxyphenyl]methanol has a molecular weight of 217.23 g/mol, XLogP of 1.34, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(6-aminopyrimidin-4-yl)oxyphenyl]methanol is sourced from PubChem (CID 80873838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).