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

C12H18N4O3 — CID 106343702

IUPAC2-[[2-(5-amino-2-oxo-1-pyridinyl)acetyl]amino]-3-methylbutanamide
SMILESCC(C)C(NC(=O)Cn1cc(N)ccc1=O)C(N)=O
InChIInChI=1S/C12H18N4O3/c1-7(2)11(12(14)19)15-9(17)6-16-5-8(13)3-4-10(16)18/h3-5,7,11H,6,13H2,1-2H3,(H2,14,19)(H,15,17)
InChIKeyZWTNULNYTYOBKZ-UHFFFAOYSA-N
MW266.30 g/mol
LogP-0.94
Rot. Bonds5

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

2-[[2-(5-amino-2-oxo-1-pyridinyl)acetyl]amino]-3-methylbutanamide (PubChem CID 106343702) has the molecular formula C12H18N4O3 and a molecular weight of 266.30 g/mol. Its IUPAC name is 2-[[2-(5-amino-2-oxo-1-pyridinyl)acetyl]amino]-3-methylbutanamide.

Molecular Properties

Compound Name2-[[2-(5-amino-2-oxo-1-pyridinyl)acetyl]amino]-3-methylbutanamide
PubChem CID106343702
Molecular FormulaC12H18N4O3
Molecular Weight266.30 g/mol
Exact Mass266.14
IUPAC Name2-[[2-(5-amino-2-oxo-1-pyridinyl)acetyl]amino]-3-methylbutanamide
SMILESCC(C)C(NC(=O)Cn1cc(N)ccc1=O)C(N)=O
InChIInChI=1S/C12H18N4O3/c1-7(2)11(12(14)19)15-9(17)6-16-5-8(13)3-4-10(16)18/h3-5,7,11H,6,13H2,1-2H3,(H2,14,19)(H,15,17)
InChIKeyZWTNULNYTYOBKZ-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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Related Compounds

2-(5-amino-2-oxo-1-pyridinyl)-N-[1-(dimethylamino)-3-methylbutan-2-yl]acetamide
CID 62815490
2-(5-amino-2-oxo-1-pyridinyl)-N-(1-phenylethyl)acetamide
CID 62816679
(1-amino-1-oxopropan-2-yl) 2-(5-amino-2-oxo-1-pyridinyl)acetate
CID 62814992
2-(5-amino-2-oxo-1-pyridinyl)-N-(1-cyclopropylbutan-2-yl)acetamide
CID 63995410
2-(5-amino-2-oxo-1-pyridinyl)-N-(4-hydroxy-2-methylbutyl)acetamide
CID 66089168
2-[[2-(2,5-dioxopyrrol-1-yl)acetyl]amino]-3-methylbutanamide
CID 164901946
3-[[2-(5-amino-2-oxo-1-pyridinyl)acetyl]amino]-2,2-dimethylpropanamide
CID 106274603
2-(5-amino-2-oxo-1-pyridinyl)-N-(1-methylcyclohexyl)acetamide
CID 62814628
1-[2-[(1-amino-3-methyl-1-oxobutan-2-yl)amino]-2-oxoethyl]pyrrole-2-carboxylic acid
CID 114176556
2-(5-amino-2-oxo-1-pyridinyl)-N-[1-(1H-pyrazol-4-yl)ethyl]acetamide
CID 106208105
2-(5-amino-2-oxo-1-pyridinyl)-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 82031682
butan-2-yl 2-(5-amino-2-oxo-1-pyridinyl)acetate
CID 62816019

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(5-amino-2-oxo-1-pyridinyl)acetyl]amino]-3-methylbutanamide?
The IUPAC name of 2-[[2-(5-amino-2-oxo-1-pyridinyl)acetyl]amino]-3-methylbutanamide (CID 106343702) is 2-[[2-(5-amino-2-oxo-1-pyridinyl)acetyl]amino]-3-methylbutanamide.
What is the SMILES notation for 2-[[2-(5-amino-2-oxo-1-pyridinyl)acetyl]amino]-3-methylbutanamide?
The canonical SMILES for 2-[[2-(5-amino-2-oxo-1-pyridinyl)acetyl]amino]-3-methylbutanamide is CC(C)C(NC(=O)Cn1cc(N)ccc1=O)C(N)=O.
What is the InChIKey of 2-[[2-(5-amino-2-oxo-1-pyridinyl)acetyl]amino]-3-methylbutanamide?
The InChIKey is ZWTNULNYTYOBKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O3/c1-7(2)11(12(14)19)15-9(17)6-16-5-8(13)3-4-10(16)18/h3-5,7,11H,6,13H2,1-2H3,(H2,14,19)(H,15,17).
What are the key properties of 2-[[2-(5-amino-2-oxo-1-pyridinyl)acetyl]amino]-3-methylbutanamide?
2-[[2-(5-amino-2-oxo-1-pyridinyl)acetyl]amino]-3-methylbutanamide 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 2-[[2-(5-amino-2-oxo-1-pyridinyl)acetyl]amino]-3-methylbutanamide is sourced from PubChem (CID 106343702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).