3-[[2-(5-amino-2-oxo-1-pyridinyl)acetyl]amino]-2,2-dimethylpropanamide

C12H18N4O3 — CID 106274603

IUPAC3-[[2-(5-amino-2-oxo-1-pyridinyl)acetyl]amino]-2,2-dimethylpropanamide
SMILESCC(C)(CNC(=O)Cn1cc(N)ccc1=O)C(N)=O
InChIInChI=1S/C12H18N4O3/c1-12(2,11(14)19)7-15-9(17)6-16-5-8(13)3-4-10(16)18/h3-5H,6-7,13H2,1-2H3,(H2,14,19)(H,15,17)
InChIKeyIJQHWYUYOXKYJF-UHFFFAOYSA-N
MW266.30 g/mol
LogP-0.94
Rot. Bonds5

About 3-[[2-(5-amino-2-oxo-1-pyridinyl)acetyl]amino]-2,2-dimethylpropanamide

3-[[2-(5-amino-2-oxo-1-pyridinyl)acetyl]amino]-2,2-dimethylpropanamide (PubChem CID 106274603) has the molecular formula C12H18N4O3 and a molecular weight of 266.30 g/mol. Its IUPAC name is 3-[[2-(5-amino-2-oxo-1-pyridinyl)acetyl]amino]-2,2-dimethylpropanamide.

Molecular Properties

Compound Name3-[[2-(5-amino-2-oxo-1-pyridinyl)acetyl]amino]-2,2-dimethylpropanamide
PubChem CID106274603
Molecular FormulaC12H18N4O3
Molecular Weight266.30 g/mol
Exact Mass266.14
IUPAC Name3-[[2-(5-amino-2-oxo-1-pyridinyl)acetyl]amino]-2,2-dimethylpropanamide
SMILESCC(C)(CNC(=O)Cn1cc(N)ccc1=O)C(N)=O
InChIInChI=1S/C12H18N4O3/c1-12(2,11(14)19)7-15-9(17)6-16-5-8(13)3-4-10(16)18/h3-5H,6-7,13H2,1-2H3,(H2,14,19)(H,15,17)
InChIKeyIJQHWYUYOXKYJF-UHFFFAOYSA-N
XLogP-0.94
TPSA120.21 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 5-0.94
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-[[2-(5-amino-2-oxo-1-pyridinyl)acetyl]amino]-2,2-dimethylpropanamide?
The IUPAC name of 3-[[2-(5-amino-2-oxo-1-pyridinyl)acetyl]amino]-2,2-dimethylpropanamide (CID 106274603) is 3-[[2-(5-amino-2-oxo-1-pyridinyl)acetyl]amino]-2,2-dimethylpropanamide.
What is the SMILES notation for 3-[[2-(5-amino-2-oxo-1-pyridinyl)acetyl]amino]-2,2-dimethylpropanamide?
The canonical SMILES for 3-[[2-(5-amino-2-oxo-1-pyridinyl)acetyl]amino]-2,2-dimethylpropanamide is CC(C)(CNC(=O)Cn1cc(N)ccc1=O)C(N)=O.
What is the InChIKey of 3-[[2-(5-amino-2-oxo-1-pyridinyl)acetyl]amino]-2,2-dimethylpropanamide?
The InChIKey is IJQHWYUYOXKYJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O3/c1-12(2,11(14)19)7-15-9(17)6-16-5-8(13)3-4-10(16)18/h3-5H,6-7,13H2,1-2H3,(H2,14,19)(H,15,17).
What are the key properties of 3-[[2-(5-amino-2-oxo-1-pyridinyl)acetyl]amino]-2,2-dimethylpropanamide?
3-[[2-(5-amino-2-oxo-1-pyridinyl)acetyl]amino]-2,2-dimethylpropanamide has a molecular weight of 266.30 g/mol, XLogP of -0.94, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[2-(5-amino-2-oxo-1-pyridinyl)acetyl]amino]-2,2-dimethylpropanamide is sourced from PubChem (CID 106274603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).