2-[4-(hydroxymethyl)pyrazin-1-yl]-N-propan-2-ylacetamide

C10H17N3O2 — CID 174470646

IUPAC2-[4-(hydroxymethyl)pyrazin-1-yl]-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)CN1C=CN(CO)C=C1
InChIInChI=1S/C10H17N3O2/c1-9(2)11-10(15)7-12-3-5-13(8-14)6-4-12/h3-6,9,14H,7-8H2,1-2H3,(H,11,15)
InChIKeyXXZSQYLXNVDZIQ-UHFFFAOYSA-N
MW211.26 g/mol
LogP0.02
Rot. Bonds4

About 2-[4-(hydroxymethyl)pyrazin-1-yl]-N-propan-2-ylacetamide

2-[4-(hydroxymethyl)pyrazin-1-yl]-N-propan-2-ylacetamide (PubChem CID 174470646) has the molecular formula C10H17N3O2 and a molecular weight of 211.26 g/mol. Its IUPAC name is 2-[4-(hydroxymethyl)pyrazin-1-yl]-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-[4-(hydroxymethyl)pyrazin-1-yl]-N-propan-2-ylacetamide
PubChem CID174470646
Molecular FormulaC10H17N3O2
Molecular Weight211.26 g/mol
Exact Mass211.13
IUPAC Name2-[4-(hydroxymethyl)pyrazin-1-yl]-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)CN1C=CN(CO)C=C1
InChIInChI=1S/C10H17N3O2/c1-9(2)11-10(15)7-12-3-5-13(8-14)6-4-12/h3-6,9,14H,7-8H2,1-2H3,(H,11,15)
InChIKeyXXZSQYLXNVDZIQ-UHFFFAOYSA-N
XLogP0.02
TPSA55.81 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 50.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-[4-(hydroxymethyl)pyrazin-1-yl]-N-propan-2-ylacetamide 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

1-Isopropyl-1,4-dihydropyrazine-2,3-dione
CID 13366346
4-[2-Oxo-2-(propylamino)ethyl]pyrazine-1-carboxylic acid
CID 91255251
(2S)-N-[(2S)-1-(ethenylamino)-1-oxopropan-2-yl]-2-(propanoylamino)propanamide
CID 146638412
4-[2-Oxo-2-(propan-2-ylamino)ethyl]pyrazine-1-carboxylic acid
CID 173173156
2-[acetyl(ethenyl)amino]-N-methylpropanamide
CID 21719896
1-[2-[2-(Diethylamino)ethylamino]ethyl]-4-methylpyrazine-2,3-dione
CID 55154901
1-Methyl-4-[4-(propylamino)butyl]pyrazine-2,3-dione
CID 55155094
1-[2-(1-Methoxypropan-2-ylamino)ethyl]-4-methylpyrazine-2,3-dione
CID 55155668
1-[4-(Ethylamino)pentyl]-4-methylpyrazine-2,3-dione
CID 55156049
1-[3-(Cyclopropylamino)-2-hydroxypropyl]-4-methylpyrazine-2,3-dione
CID 55156241
1-[3-(Ethylamino)propyl]-4-methylpyrazine-2,3-dione
CID 62927178
1-Methyl-4-[4-(propan-2-ylamino)butyl]pyrazine-2,3-dione
CID 62927193

Frequently Asked Questions

What is the IUPAC name of 2-[4-(hydroxymethyl)pyrazin-1-yl]-N-propan-2-ylacetamide?
The IUPAC name of 2-[4-(hydroxymethyl)pyrazin-1-yl]-N-propan-2-ylacetamide (CID 174470646) is 2-[4-(hydroxymethyl)pyrazin-1-yl]-N-propan-2-ylacetamide.
What is the SMILES notation for 2-[4-(hydroxymethyl)pyrazin-1-yl]-N-propan-2-ylacetamide?
The canonical SMILES for 2-[4-(hydroxymethyl)pyrazin-1-yl]-N-propan-2-ylacetamide is CC(C)NC(=O)CN1C=CN(CO)C=C1.
What is the InChIKey of 2-[4-(hydroxymethyl)pyrazin-1-yl]-N-propan-2-ylacetamide?
The InChIKey is XXZSQYLXNVDZIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O2/c1-9(2)11-10(15)7-12-3-5-13(8-14)6-4-12/h3-6,9,14H,7-8H2,1-2H3,(H,11,15).
What are the key properties of 2-[4-(hydroxymethyl)pyrazin-1-yl]-N-propan-2-ylacetamide?
2-[4-(hydroxymethyl)pyrazin-1-yl]-N-propan-2-ylacetamide has a molecular weight of 211.26 g/mol, XLogP of 0.02, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(hydroxymethyl)pyrazin-1-yl]-N-propan-2-ylacetamide is sourced from PubChem (CID 174470646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).