(1R)-1-(4-pyrazin-2-yloxyphenyl)ethanol

C12H12N2O2 — CID 7101331

IUPAC(1R)-1-(4-pyrazin-2-yloxyphenyl)ethanol
SMILESC[C@@H](O)c1ccc(Oc2cnccn2)cc1
InChIInChI=1S/C12H12N2O2/c1-9(15)10-2-4-11(5-3-10)16-12-8-13-6-7-14-12/h2-9,15H,1H3/t9-/m1/s1
InChIKeyVCRGSWFVKGVGHD-SECBINFHSA-N
MW216.24 g/mol
LogP2.32
Rot. Bonds3

About (1R)-1-(4-pyrazin-2-yloxyphenyl)ethanol

(1R)-1-(4-pyrazin-2-yloxyphenyl)ethanol (PubChem CID 7101331) has the molecular formula C12H12N2O2 and a molecular weight of 216.24 g/mol. Its IUPAC name is (1R)-1-(4-pyrazin-2-yloxyphenyl)ethanol.

Molecular Properties

Compound Name(1R)-1-(4-pyrazin-2-yloxyphenyl)ethanol
PubChem CID7101331
Molecular FormulaC12H12N2O2
Molecular Weight216.24 g/mol
Exact Mass216.09
IUPAC Name(1R)-1-(4-pyrazin-2-yloxyphenyl)ethanol
SMILESC[C@@H](O)c1ccc(Oc2cnccn2)cc1
InChIInChI=1S/C12H12N2O2/c1-9(15)10-2-4-11(5-3-10)16-12-8-13-6-7-14-12/h2-9,15H,1H3/t9-/m1/s1
InChIKeyVCRGSWFVKGVGHD-SECBINFHSA-N
XLogP2.32
TPSA55.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.24
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-pyrazin-2-yloxyphenoxy)pyrazine
CID 101444877
2-(4-phenylphenoxy)pyrazine
CID 518373
(1S)-1-[2-(4-butan-2-ylphenoxy)-4-pyridinyl]ethanol
CID 107665917
1-(4-phenoxyphenyl)ethanol;hydrochloride
CID 67663526
4-methyl-2-[(4-pyrazin-2-yloxyphenyl)methylamino]pentan-1-ol
CID 111478244
(1S)-1-[4-(4-methoxypyrimidin-2-yl)oxyphenyl]ethanol
CID 94830433
1-[4-(pyridin-3-ylmethoxy)phenyl]ethanol
CID 43503736
(1S)-1-[4-(4-methoxyphenoxy)phenyl]ethanol
CID 63372514
(1R)-1-[4-[(5-chloro-3-pyridinyl)oxy]phenyl]ethanol
CID 64600997
2-[4-(pyridin-3-ylmethoxy)phenoxy]pyrazine
CID 167789022
1-(furan-2-yl)-N-methyl-N-[(4-pyrazin-2-yloxyphenyl)methyl]ethanamine
CID 75438545
N-[(4-pyrazin-2-yloxyphenyl)methyl]pyrimidin-2-amine
CID 86804405

Frequently Asked Questions

What is the IUPAC name of (1R)-1-(4-pyrazin-2-yloxyphenyl)ethanol?
The IUPAC name of (1R)-1-(4-pyrazin-2-yloxyphenyl)ethanol (CID 7101331) is (1R)-1-(4-pyrazin-2-yloxyphenyl)ethanol.
What is the SMILES notation for (1R)-1-(4-pyrazin-2-yloxyphenyl)ethanol?
The canonical SMILES for (1R)-1-(4-pyrazin-2-yloxyphenyl)ethanol is C[C@@H](O)c1ccc(Oc2cnccn2)cc1.
What is the InChIKey of (1R)-1-(4-pyrazin-2-yloxyphenyl)ethanol?
The InChIKey is VCRGSWFVKGVGHD-SECBINFHSA-N. The full InChI is InChI=1S/C12H12N2O2/c1-9(15)10-2-4-11(5-3-10)16-12-8-13-6-7-14-12/h2-9,15H,1H3/t9-/m1/s1.
What are the key properties of (1R)-1-(4-pyrazin-2-yloxyphenyl)ethanol?
(1R)-1-(4-pyrazin-2-yloxyphenyl)ethanol has a molecular weight of 216.24 g/mol, XLogP of 2.32, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-(4-pyrazin-2-yloxyphenyl)ethanol is sourced from PubChem (CID 7101331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).