2-amino-2-(7-fluoro-4-oxopyrido[1,2-a]pyrimidin-2-yl)acetamide

C10H9FN4O2 — CID 169193662

IUPAC2-amino-2-(7-fluoro-4-oxopyrido[1,2-a]pyrimidin-2-yl)acetamide
SMILESNC(=O)C(N)c1cc(=O)n2cc(F)ccc2n1
InChIInChI=1S/C10H9FN4O2/c11-5-1-2-7-14-6(9(12)10(13)17)3-8(16)15(7)4-5/h1-4,9H,12H2,(H2,13,17)
InChIKeyDAIGIBQKKCILCZ-UHFFFAOYSA-N
MW236.21 g/mol
LogP-0.68
Rot. Bonds2

About 2-amino-2-(7-fluoro-4-oxopyrido[1,2-a]pyrimidin-2-yl)acetamide

2-amino-2-(7-fluoro-4-oxopyrido[1,2-a]pyrimidin-2-yl)acetamide (PubChem CID 169193662) has the molecular formula C10H9FN4O2 and a molecular weight of 236.21 g/mol. Its IUPAC name is 2-amino-2-(7-fluoro-4-oxopyrido[1,2-a]pyrimidin-2-yl)acetamide.

Molecular Properties

Compound Name2-amino-2-(7-fluoro-4-oxopyrido[1,2-a]pyrimidin-2-yl)acetamide
PubChem CID169193662
Molecular FormulaC10H9FN4O2
Molecular Weight236.21 g/mol
Exact Mass236.07
IUPAC Name2-amino-2-(7-fluoro-4-oxopyrido[1,2-a]pyrimidin-2-yl)acetamide
SMILESNC(=O)C(N)c1cc(=O)n2cc(F)ccc2n1
InChIInChI=1S/C10H9FN4O2/c11-5-1-2-7-14-6(9(12)10(13)17)3-8(16)15(7)4-5/h1-4,9H,12H2,(H2,13,17)
InChIKeyDAIGIBQKKCILCZ-UHFFFAOYSA-N
XLogP-0.68
TPSA103.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.21
LogP ≤ 5-0.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-amino-2-(7-fluoro-4-oxopyrido[1,2-a]pyrimidin-2-yl)acetamide?
The IUPAC name of 2-amino-2-(7-fluoro-4-oxopyrido[1,2-a]pyrimidin-2-yl)acetamide (CID 169193662) is 2-amino-2-(7-fluoro-4-oxopyrido[1,2-a]pyrimidin-2-yl)acetamide.
What is the SMILES notation for 2-amino-2-(7-fluoro-4-oxopyrido[1,2-a]pyrimidin-2-yl)acetamide?
The canonical SMILES for 2-amino-2-(7-fluoro-4-oxopyrido[1,2-a]pyrimidin-2-yl)acetamide is NC(=O)C(N)c1cc(=O)n2cc(F)ccc2n1.
What is the InChIKey of 2-amino-2-(7-fluoro-4-oxopyrido[1,2-a]pyrimidin-2-yl)acetamide?
The InChIKey is DAIGIBQKKCILCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9FN4O2/c11-5-1-2-7-14-6(9(12)10(13)17)3-8(16)15(7)4-5/h1-4,9H,12H2,(H2,13,17).
What are the key properties of 2-amino-2-(7-fluoro-4-oxopyrido[1,2-a]pyrimidin-2-yl)acetamide?
2-amino-2-(7-fluoro-4-oxopyrido[1,2-a]pyrimidin-2-yl)acetamide has a molecular weight of 236.21 g/mol, XLogP of -0.68, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-(7-fluoro-4-oxopyrido[1,2-a]pyrimidin-2-yl)acetamide is sourced from PubChem (CID 169193662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).