2-[(2-oxo-1H-pyrazin-3-yl)amino]-N-propan-2-ylacetamide

C9H14N4O2 — CID 115650193

IUPAC2-[(2-oxo-1H-pyrazin-3-yl)amino]-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)CNc1ncc[nH]c1=O
InChIInChI=1S/C9H14N4O2/c1-6(2)13-7(14)5-12-8-9(15)11-4-3-10-8/h3-4,6H,5H2,1-2H3,(H,10,12)(H,11,15)(H,13,14)
InChIKeyBSANGKMKKFHQSX-UHFFFAOYSA-N
MW210.24 g/mol
LogP-0.29
Rot. Bonds4

About 2-[(2-oxo-1H-pyrazin-3-yl)amino]-N-propan-2-ylacetamide

2-[(2-oxo-1H-pyrazin-3-yl)amino]-N-propan-2-ylacetamide (PubChem CID 115650193) has the molecular formula C9H14N4O2 and a molecular weight of 210.24 g/mol. Its IUPAC name is 2-[(2-oxo-1H-pyrazin-3-yl)amino]-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-[(2-oxo-1H-pyrazin-3-yl)amino]-N-propan-2-ylacetamide
PubChem CID115650193
Molecular FormulaC9H14N4O2
Molecular Weight210.24 g/mol
Exact Mass210.11
IUPAC Name2-[(2-oxo-1H-pyrazin-3-yl)amino]-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)CNc1ncc[nH]c1=O
InChIInChI=1S/C9H14N4O2/c1-6(2)13-7(14)5-12-8-9(15)11-4-3-10-8/h3-4,6H,5H2,1-2H3,(H,10,12)(H,11,15)(H,13,14)
InChIKeyBSANGKMKKFHQSX-UHFFFAOYSA-N
XLogP-0.29
TPSA86.88 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.24
LogP ≤ 5-0.29
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-methylpropyl)-3-[(2-oxo-1H-pyrazin-3-yl)amino]propanamide
CID 114569295
3-[(2-hydroxy-2,4-dimethylpentyl)amino]-1H-pyrazin-2-one
CID 114569048
3-[(2-amino-3-hydroxypropyl)amino]-1H-pyrazin-2-one
CID 127009394
3-[[(2S)-1-hydroxy-3-methylbutan-2-yl]amino]-1H-pyrazin-2-one
CID 114986519
3-[(2-oxo-1H-pyrazin-3-yl)amino]butanamide
CID 115685000
3-[(3-methoxy-2-methylpropyl)amino]-1H-pyrazin-2-one
CID 115657236
3-[2-(dimethylamino)ethylamino]-1H-pyrazin-2-one
CID 115897525
5,5-dimethyl-3-[(2-oxo-1H-pyrazin-3-yl)amino]hexanoic acid
CID 114570600
2-[(3-methylsulfonyl-2-pyridinyl)amino]-N-propan-2-ylacetamide
CID 114598664
N-(2-methylpropyl)-2-[(2-oxo-1H-pyrazin-3-yl)amino]propanamide
CID 114569242
N,N-dimethyl-2-[(2-oxo-1H-pyrazin-3-yl)amino]propanamide
CID 115898862
2-ethenyl-1H-imidazole;N-propan-2-ylprop-2-enamide
CID 158112506

Frequently Asked Questions

What is the IUPAC name of 2-[(2-oxo-1H-pyrazin-3-yl)amino]-N-propan-2-ylacetamide?
The IUPAC name of 2-[(2-oxo-1H-pyrazin-3-yl)amino]-N-propan-2-ylacetamide (CID 115650193) is 2-[(2-oxo-1H-pyrazin-3-yl)amino]-N-propan-2-ylacetamide.
What is the SMILES notation for 2-[(2-oxo-1H-pyrazin-3-yl)amino]-N-propan-2-ylacetamide?
The canonical SMILES for 2-[(2-oxo-1H-pyrazin-3-yl)amino]-N-propan-2-ylacetamide is CC(C)NC(=O)CNc1ncc[nH]c1=O.
What is the InChIKey of 2-[(2-oxo-1H-pyrazin-3-yl)amino]-N-propan-2-ylacetamide?
The InChIKey is BSANGKMKKFHQSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N4O2/c1-6(2)13-7(14)5-12-8-9(15)11-4-3-10-8/h3-4,6H,5H2,1-2H3,(H,10,12)(H,11,15)(H,13,14).
What are the key properties of 2-[(2-oxo-1H-pyrazin-3-yl)amino]-N-propan-2-ylacetamide?
2-[(2-oxo-1H-pyrazin-3-yl)amino]-N-propan-2-ylacetamide has a molecular weight of 210.24 g/mol, XLogP of -0.29, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-oxo-1H-pyrazin-3-yl)amino]-N-propan-2-ylacetamide is sourced from PubChem (CID 115650193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).