2-methyl-7,8-dihydro-6H-pyrido[1,2-a]pyrimidine-4,9-dione

C9H10N2O2 — CID 70245643

IUPAC2-methyl-7,8-dihydro-6H-pyrido[1,2-a]pyrimidine-4,9-dione
SMILESCc1cc(=O)n2c(n1)C(=O)CCC2
InChIInChI=1S/C9H10N2O2/c1-6-5-8(13)11-4-2-3-7(12)9(11)10-6/h5H,2-4H2,1H3
InChIKeyGGWXSOUCLDPUHA-UHFFFAOYSA-N
MW178.19 g/mol
LogP0.53
Rot. Bonds

About 2-methyl-7,8-dihydro-6H-pyrido[1,2-a]pyrimidine-4,9-dione

2-methyl-7,8-dihydro-6H-pyrido[1,2-a]pyrimidine-4,9-dione (PubChem CID 70245643) has the molecular formula C9H10N2O2 and a molecular weight of 178.19 g/mol. Its IUPAC name is 2-methyl-7,8-dihydro-6H-pyrido[1,2-a]pyrimidine-4,9-dione.

Molecular Properties

Compound Name2-methyl-7,8-dihydro-6H-pyrido[1,2-a]pyrimidine-4,9-dione
PubChem CID70245643
Molecular FormulaC9H10N2O2
Molecular Weight178.19 g/mol
Exact Mass178.07
IUPAC Name2-methyl-7,8-dihydro-6H-pyrido[1,2-a]pyrimidine-4,9-dione
SMILESCc1cc(=O)n2c(n1)C(=O)CCC2
InChIInChI=1S/C9H10N2O2/c1-6-5-8(13)11-4-2-3-7(12)9(11)10-6/h5H,2-4H2,1H3
InChIKeyGGWXSOUCLDPUHA-UHFFFAOYSA-N
XLogP0.53
TPSA51.96 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.19
LogP ≤ 50.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-7,8-dihydro-6H-pyrido[1,2-a]pyrimidine-4,9-dione?
The IUPAC name of 2-methyl-7,8-dihydro-6H-pyrido[1,2-a]pyrimidine-4,9-dione (CID 70245643) is 2-methyl-7,8-dihydro-6H-pyrido[1,2-a]pyrimidine-4,9-dione.
What is the SMILES notation for 2-methyl-7,8-dihydro-6H-pyrido[1,2-a]pyrimidine-4,9-dione?
The canonical SMILES for 2-methyl-7,8-dihydro-6H-pyrido[1,2-a]pyrimidine-4,9-dione is Cc1cc(=O)n2c(n1)C(=O)CCC2.
What is the InChIKey of 2-methyl-7,8-dihydro-6H-pyrido[1,2-a]pyrimidine-4,9-dione?
The InChIKey is GGWXSOUCLDPUHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2O2/c1-6-5-8(13)11-4-2-3-7(12)9(11)10-6/h5H,2-4H2,1H3.
What are the key properties of 2-methyl-7,8-dihydro-6H-pyrido[1,2-a]pyrimidine-4,9-dione?
2-methyl-7,8-dihydro-6H-pyrido[1,2-a]pyrimidine-4,9-dione has a molecular weight of 178.19 g/mol, XLogP of 0.53, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-7,8-dihydro-6H-pyrido[1,2-a]pyrimidine-4,9-dione is sourced from PubChem (CID 70245643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).