3-[2-hydroxyethyl(methyl)amino]-1-pyrazin-2-ylpropan-1-one

C10H15N3O2 — CID 46231508

IUPAC3-[2-hydroxyethyl(methyl)amino]-1-pyrazin-2-ylpropan-1-one
SMILESCN(CCO)CCC(=O)c1cnccn1
InChIInChI=1S/C10H15N3O2/c1-13(6-7-14)5-2-10(15)9-8-11-3-4-12-9/h3-4,8,14H,2,5-7H2,1H3
InChIKeyZIOFKPMOUIZAMM-UHFFFAOYSA-N
MW209.25 g/mol
LogP-0.03
Rot. Bonds6

About 3-[2-hydroxyethyl(methyl)amino]-1-pyrazin-2-ylpropan-1-one

3-[2-hydroxyethyl(methyl)amino]-1-pyrazin-2-ylpropan-1-one (PubChem CID 46231508) has the molecular formula C10H15N3O2 and a molecular weight of 209.25 g/mol. Its IUPAC name is 3-[2-hydroxyethyl(methyl)amino]-1-pyrazin-2-ylpropan-1-one.

Molecular Properties

Compound Name3-[2-hydroxyethyl(methyl)amino]-1-pyrazin-2-ylpropan-1-one
PubChem CID46231508
Molecular FormulaC10H15N3O2
Molecular Weight209.25 g/mol
Exact Mass209.12
IUPAC Name3-[2-hydroxyethyl(methyl)amino]-1-pyrazin-2-ylpropan-1-one
SMILESCN(CCO)CCC(=O)c1cnccn1
InChIInChI=1S/C10H15N3O2/c1-13(6-7-14)5-2-10(15)9-8-11-3-4-12-9/h3-4,8,14H,2,5-7H2,1H3
InChIKeyZIOFKPMOUIZAMM-UHFFFAOYSA-N
XLogP-0.03
TPSA66.32 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 5-0.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-[2-hydroxyethyl(methyl)amino]-1-pyrazin-2-ylpropan-1-one?
The IUPAC name of 3-[2-hydroxyethyl(methyl)amino]-1-pyrazin-2-ylpropan-1-one (CID 46231508) is 3-[2-hydroxyethyl(methyl)amino]-1-pyrazin-2-ylpropan-1-one.
What is the SMILES notation for 3-[2-hydroxyethyl(methyl)amino]-1-pyrazin-2-ylpropan-1-one?
The canonical SMILES for 3-[2-hydroxyethyl(methyl)amino]-1-pyrazin-2-ylpropan-1-one is CN(CCO)CCC(=O)c1cnccn1.
What is the InChIKey of 3-[2-hydroxyethyl(methyl)amino]-1-pyrazin-2-ylpropan-1-one?
The InChIKey is ZIOFKPMOUIZAMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2/c1-13(6-7-14)5-2-10(15)9-8-11-3-4-12-9/h3-4,8,14H,2,5-7H2,1H3.
What are the key properties of 3-[2-hydroxyethyl(methyl)amino]-1-pyrazin-2-ylpropan-1-one?
3-[2-hydroxyethyl(methyl)amino]-1-pyrazin-2-ylpropan-1-one has a molecular weight of 209.25 g/mol, XLogP of -0.03, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-hydroxyethyl(methyl)amino]-1-pyrazin-2-ylpropan-1-one is sourced from PubChem (CID 46231508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).