2-[2-[5-(aminomethyl)pyrazin-2-yl]oxyphenyl]ethanol

C13H15N3O2 — CID 107711701

IUPAC2-[2-[5-(aminomethyl)pyrazin-2-yl]oxyphenyl]ethanol
SMILESNCc1cnc(Oc2ccccc2CCO)cn1
InChIInChI=1S/C13H15N3O2/c14-7-11-8-16-13(9-15-11)18-12-4-2-1-3-10(12)5-6-17/h1-4,8-9,17H,5-7,14H2
InChIKeyCLKXDQPVRWRXNK-UHFFFAOYSA-N
MW245.28 g/mol
LogP1.26
Rot. Bonds5

About 2-[2-[5-(aminomethyl)pyrazin-2-yl]oxyphenyl]ethanol

2-[2-[5-(aminomethyl)pyrazin-2-yl]oxyphenyl]ethanol (PubChem CID 107711701) has the molecular formula C13H15N3O2 and a molecular weight of 245.28 g/mol. Its IUPAC name is 2-[2-[5-(aminomethyl)pyrazin-2-yl]oxyphenyl]ethanol.

Molecular Properties

Compound Name2-[2-[5-(aminomethyl)pyrazin-2-yl]oxyphenyl]ethanol
PubChem CID107711701
Molecular FormulaC13H15N3O2
Molecular Weight245.28 g/mol
Exact Mass245.12
IUPAC Name2-[2-[5-(aminomethyl)pyrazin-2-yl]oxyphenyl]ethanol
SMILESNCc1cnc(Oc2ccccc2CCO)cn1
InChIInChI=1S/C13H15N3O2/c14-7-11-8-16-13(9-15-11)18-12-4-2-1-3-10(12)5-6-17/h1-4,8-9,17H,5-7,14H2
InChIKeyCLKXDQPVRWRXNK-UHFFFAOYSA-N
XLogP1.26
TPSA81.26 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.28
LogP ≤ 51.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-[2-[5-(aminomethyl)pyrazin-2-yl]oxyphenyl]ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-[2-(2-hydroxyethyl)phenoxy]pyrazine-2-carbothioamide
CID 107712486
2-[2-[[4-(aminomethyl)-2-pyridinyl]oxy]phenyl]ethanol
CID 107711711
6-[2-(2-hydroxyethyl)phenoxy]pyridine-3-carbaldehyde
CID 107712774
2-[2-[[5-[1-(methylamino)ethyl]-2-pyridinyl]oxy]phenyl]ethanol
CID 107712729
N-[[5-(2-ethylphenoxy)pyrazin-2-yl]methyl]ethanamine
CID 107382000
2-[2-(3-aminopropoxy)phenyl]ethanol
CID 107712249
2-[2-[[4-(aminomethyl)phenyl]methoxy]phenyl]ethanol
CID 107712248
2-[2-(6-methylsulfanylpyrimidin-4-yl)oxyphenyl]ethanol
CID 107713792
2-(2-pyrido[2,3-b]pyrazin-6-yloxyphenyl)ethanol
CID 107713779
2-[2-[2-(aminomethyl)-4-methylphenoxy]phenyl]ethanol
CID 107926570
2-[2-[(5-amino-3-bromo-4-methyl-2-pyridinyl)oxy]phenyl]ethanol
CID 107712102
2-[2-[2-(aminomethyl)-5-chlorophenoxy]phenyl]ethanol
CID 107711772

Frequently Asked Questions

What is the IUPAC name of 2-[2-[5-(aminomethyl)pyrazin-2-yl]oxyphenyl]ethanol?
The IUPAC name of 2-[2-[5-(aminomethyl)pyrazin-2-yl]oxyphenyl]ethanol (CID 107711701) is 2-[2-[5-(aminomethyl)pyrazin-2-yl]oxyphenyl]ethanol.
What is the SMILES notation for 2-[2-[5-(aminomethyl)pyrazin-2-yl]oxyphenyl]ethanol?
The canonical SMILES for 2-[2-[5-(aminomethyl)pyrazin-2-yl]oxyphenyl]ethanol is NCc1cnc(Oc2ccccc2CCO)cn1.
What is the InChIKey of 2-[2-[5-(aminomethyl)pyrazin-2-yl]oxyphenyl]ethanol?
The InChIKey is CLKXDQPVRWRXNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O2/c14-7-11-8-16-13(9-15-11)18-12-4-2-1-3-10(12)5-6-17/h1-4,8-9,17H,5-7,14H2.
What are the key properties of 2-[2-[5-(aminomethyl)pyrazin-2-yl]oxyphenyl]ethanol?
2-[2-[5-(aminomethyl)pyrazin-2-yl]oxyphenyl]ethanol has a molecular weight of 245.28 g/mol, XLogP of 1.26, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[5-(aminomethyl)pyrazin-2-yl]oxyphenyl]ethanol is sourced from PubChem (CID 107711701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).