2-[2-(5-amino-2-oxo-1-pyridinyl)ethyl-propan-2-ylamino]acetamide

C12H20N4O2 — CID 54989117

IUPAC2-[2-(5-amino-2-oxo-1-pyridinyl)ethyl-propan-2-ylamino]acetamide
SMILESCC(C)N(CCn1cc(N)ccc1=O)CC(N)=O
InChIInChI=1S/C12H20N4O2/c1-9(2)15(8-11(14)17)5-6-16-7-10(13)3-4-12(16)18/h3-4,7,9H,5-6,8,13H2,1-2H3,(H2,14,17)
InChIKeyXGGBFBOQTRRLFK-UHFFFAOYSA-N
MW252.32 g/mol
LogP-0.37
Rot. Bonds6

About 2-[2-(5-amino-2-oxo-1-pyridinyl)ethyl-propan-2-ylamino]acetamide

2-[2-(5-amino-2-oxo-1-pyridinyl)ethyl-propan-2-ylamino]acetamide (PubChem CID 54989117) has the molecular formula C12H20N4O2 and a molecular weight of 252.32 g/mol. Its IUPAC name is 2-[2-(5-amino-2-oxo-1-pyridinyl)ethyl-propan-2-ylamino]acetamide.

Molecular Properties

Compound Name2-[2-(5-amino-2-oxo-1-pyridinyl)ethyl-propan-2-ylamino]acetamide
PubChem CID54989117
Molecular FormulaC12H20N4O2
Molecular Weight252.32 g/mol
Exact Mass252.16
IUPAC Name2-[2-(5-amino-2-oxo-1-pyridinyl)ethyl-propan-2-ylamino]acetamide
SMILESCC(C)N(CCn1cc(N)ccc1=O)CC(N)=O
InChIInChI=1S/C12H20N4O2/c1-9(2)15(8-11(14)17)5-6-16-7-10(13)3-4-12(16)18/h3-4,7,9H,5-6,8,13H2,1-2H3,(H2,14,17)
InChIKeyXGGBFBOQTRRLFK-UHFFFAOYSA-N
XLogP-0.37
TPSA94.35 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 5-0.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(5-amino-2-oxo-1-pyridinyl)ethyl-propan-2-ylamino]acetamide?
The IUPAC name of 2-[2-(5-amino-2-oxo-1-pyridinyl)ethyl-propan-2-ylamino]acetamide (CID 54989117) is 2-[2-(5-amino-2-oxo-1-pyridinyl)ethyl-propan-2-ylamino]acetamide.
What is the SMILES notation for 2-[2-(5-amino-2-oxo-1-pyridinyl)ethyl-propan-2-ylamino]acetamide?
The canonical SMILES for 2-[2-(5-amino-2-oxo-1-pyridinyl)ethyl-propan-2-ylamino]acetamide is CC(C)N(CCn1cc(N)ccc1=O)CC(N)=O.
What is the InChIKey of 2-[2-(5-amino-2-oxo-1-pyridinyl)ethyl-propan-2-ylamino]acetamide?
The InChIKey is XGGBFBOQTRRLFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O2/c1-9(2)15(8-11(14)17)5-6-16-7-10(13)3-4-12(16)18/h3-4,7,9H,5-6,8,13H2,1-2H3,(H2,14,17).
What are the key properties of 2-[2-(5-amino-2-oxo-1-pyridinyl)ethyl-propan-2-ylamino]acetamide?
2-[2-(5-amino-2-oxo-1-pyridinyl)ethyl-propan-2-ylamino]acetamide has a molecular weight of 252.32 g/mol, XLogP of -0.37, 6 rotatable bonds, 2 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)ethyl-propan-2-ylamino]acetamide is sourced from PubChem (CID 54989117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).