N-(8-methyl-4-oxo-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-3-yl)acetamide

C11H15N3O2 — CID 10680507

IUPACN-(8-methyl-4-oxo-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-3-yl)acetamide
SMILESCC(=O)Nc1cnc2n(c1=O)CCC(C)C2
InChIInChI=1S/C11H15N3O2/c1-7-3-4-14-10(5-7)12-6-9(11(14)16)13-8(2)15/h6-7H,3-5H2,1-2H3,(H,13,15)
InChIKeyIAPVDAHQWGEOQP-UHFFFAOYSA-N
MW221.26 g/mol
LogP0.78
Rot. Bonds1

About N-(8-methyl-4-oxo-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-3-yl)acetamide

N-(8-methyl-4-oxo-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-3-yl)acetamide (PubChem CID 10680507) has the molecular formula C11H15N3O2 and a molecular weight of 221.26 g/mol. Its IUPAC name is N-(8-methyl-4-oxo-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-3-yl)acetamide.

Molecular Properties

Compound NameN-(8-methyl-4-oxo-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-3-yl)acetamide
PubChem CID10680507
Molecular FormulaC11H15N3O2
Molecular Weight221.26 g/mol
Exact Mass221.12
IUPAC NameN-(8-methyl-4-oxo-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-3-yl)acetamide
SMILESCC(=O)Nc1cnc2n(c1=O)CCC(C)C2
InChIInChI=1S/C11H15N3O2/c1-7-3-4-14-10(5-7)12-6-9(11(14)16)13-8(2)15/h6-7H,3-5H2,1-2H3,(H,13,15)
InChIKeyIAPVDAHQWGEOQP-UHFFFAOYSA-N
XLogP0.78
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 50.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

7-Acetyl-3-(methylamino)-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one
CID 54448739
(6R)-6-methyl-3-(methylamino)-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one
CID 58700505
5-[4-[[bis(3-aminopropyl)amino]methyl]piperidin-1-yl]-2-methyl-1H-pyrimidin-6-one
CID 66581314
2-[3-[[1-(2-methyl-6-oxo-1H-pyrimidin-5-yl)piperidin-4-yl]methylamino]propyl]guanidine
CID 66581807
2-[3-[[1-(2-tert-butyl-6-oxo-1H-pyrimidin-5-yl)piperidin-4-yl]methylamino]propyl]guanidine
CID 89492859
2-[3-[[1-(2-tert-butyl-6-oxo-1H-pyrimidin-5-yl)piperidin-4-yl]methyl-[3-(diaminomethylideneamino)propyl]amino]propyl]guanidine
CID 89492861
5-[4-[(3-aminopropylamino)methyl]piperidin-1-yl]-2-tert-butyl-1H-pyrimidin-6-one
CID 89492863
5-[4-[[bis(3-aminopropyl)amino]methyl]piperidin-1-yl]-2-tert-butyl-1H-pyrimidin-6-one
CID 89492864
2-[3-[3-(diaminomethylideneamino)propyl-[[1-(2-methyl-6-oxo-1H-pyrimidin-5-yl)piperidin-4-yl]methyl]amino]propyl]guanidine
CID 89495139
5-[4-[(3-aminopropylamino)methyl]piperidin-1-yl]-2-methyl-1H-pyrimidin-6-one
CID 89495155
6-propan-2-yl-3,4-dihydro-2H-pyrazino[1,2-c]pyrimidine-1,8-dione
CID 129079763
5-[4-[(3-aminopropylamino)methyl]piperidin-1-yl]-2-(2-methylbutan-2-yl)-1H-pyrimidin-6-one
CID 132234565

Frequently Asked Questions

What is the IUPAC name of N-(8-methyl-4-oxo-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-3-yl)acetamide?
The IUPAC name of N-(8-methyl-4-oxo-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-3-yl)acetamide (CID 10680507) is N-(8-methyl-4-oxo-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-3-yl)acetamide.
What is the SMILES notation for N-(8-methyl-4-oxo-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-3-yl)acetamide?
The canonical SMILES for N-(8-methyl-4-oxo-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-3-yl)acetamide is CC(=O)Nc1cnc2n(c1=O)CCC(C)C2.
What is the InChIKey of N-(8-methyl-4-oxo-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-3-yl)acetamide?
The InChIKey is IAPVDAHQWGEOQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O2/c1-7-3-4-14-10(5-7)12-6-9(11(14)16)13-8(2)15/h6-7H,3-5H2,1-2H3,(H,13,15).
What are the key properties of N-(8-methyl-4-oxo-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-3-yl)acetamide?
N-(8-methyl-4-oxo-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-3-yl)acetamide has a molecular weight of 221.26 g/mol, XLogP of 0.78, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(8-methyl-4-oxo-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-3-yl)acetamide is sourced from PubChem (CID 10680507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).