2-(methylamino)-N-(4-oxo-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-2-yl)acetamide

C11H16N4O2 — CID 164573864

IUPAC2-(methylamino)-N-(4-oxo-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-2-yl)acetamide
SMILESCNCC(=O)Nc1cc(=O)n2c(n1)CCCC2
InChIInChI=1S/C11H16N4O2/c1-12-7-10(16)14-8-6-11(17)15-5-3-2-4-9(15)13-8/h6,12H,2-5,7H2,1H3,(H,14,16)
InChIKeyYTDPVCFCOQBAHN-UHFFFAOYSA-N
MW236.27 g/mol
LogP-0.26
Rot. Bonds3

About 2-(methylamino)-N-(4-oxo-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-2-yl)acetamide

2-(methylamino)-N-(4-oxo-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-2-yl)acetamide (PubChem CID 164573864) has the molecular formula C11H16N4O2 and a molecular weight of 236.27 g/mol. Its IUPAC name is 2-(methylamino)-N-(4-oxo-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-2-yl)acetamide.

Molecular Properties

Compound Name2-(methylamino)-N-(4-oxo-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-2-yl)acetamide
PubChem CID164573864
Molecular FormulaC11H16N4O2
Molecular Weight236.27 g/mol
Exact Mass236.13
IUPAC Name2-(methylamino)-N-(4-oxo-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-2-yl)acetamide
SMILESCNCC(=O)Nc1cc(=O)n2c(n1)CCCC2
InChIInChI=1S/C11H16N4O2/c1-12-7-10(16)14-8-6-11(17)15-5-3-2-4-9(15)13-8/h6,12H,2-5,7H2,1H3,(H,14,16)
InChIKeyYTDPVCFCOQBAHN-UHFFFAOYSA-N
XLogP-0.26
TPSA76.02 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.27
LogP ≤ 5-0.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-N-(4-oxo-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-2-yl)acetamide?
The IUPAC name of 2-(methylamino)-N-(4-oxo-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-2-yl)acetamide (CID 164573864) is 2-(methylamino)-N-(4-oxo-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-2-yl)acetamide.
What is the SMILES notation for 2-(methylamino)-N-(4-oxo-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-2-yl)acetamide?
The canonical SMILES for 2-(methylamino)-N-(4-oxo-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-2-yl)acetamide is CNCC(=O)Nc1cc(=O)n2c(n1)CCCC2.
What is the InChIKey of 2-(methylamino)-N-(4-oxo-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-2-yl)acetamide?
The InChIKey is YTDPVCFCOQBAHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O2/c1-12-7-10(16)14-8-6-11(17)15-5-3-2-4-9(15)13-8/h6,12H,2-5,7H2,1H3,(H,14,16).
What are the key properties of 2-(methylamino)-N-(4-oxo-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-2-yl)acetamide?
2-(methylamino)-N-(4-oxo-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-2-yl)acetamide has a molecular weight of 236.27 g/mol, XLogP of -0.26, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-N-(4-oxo-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-2-yl)acetamide is sourced from PubChem (CID 164573864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).