5-methyl-8H-imidazo[1,2-a]pyrimidin-7-one

C7H7N3O — CID 76849717

IUPAC5-methyl-8H-imidazo[1,2-a]pyrimidin-7-one
SMILESCc1cc(=O)[nH]c2nccn12
InChIInChI=1S/C7H7N3O/c1-5-4-6(11)9-7-8-2-3-10(5)7/h2-4H,1H3,(H,8,9,11)
InChIKeyGVWALDUEYDNXOO-UHFFFAOYSA-N
MW149.15 g/mol
LogP0.33
Rot. Bonds

About 5-methyl-8H-imidazo[1,2-a]pyrimidin-7-one

5-methyl-8H-imidazo[1,2-a]pyrimidin-7-one (PubChem CID 76849717) has the molecular formula C7H7N3O and a molecular weight of 149.15 g/mol. Its IUPAC name is 5-methyl-8H-imidazo[1,2-a]pyrimidin-7-one.

Molecular Properties

Compound Name5-methyl-8H-imidazo[1,2-a]pyrimidin-7-one
PubChem CID76849717
Molecular FormulaC7H7N3O
Molecular Weight149.15 g/mol
Exact Mass149.06
IUPAC Name5-methyl-8H-imidazo[1,2-a]pyrimidin-7-one
SMILESCc1cc(=O)[nH]c2nccn12
InChIInChI=1S/C7H7N3O/c1-5-4-6(11)9-7-8-2-3-10(5)7/h2-4H,1H3,(H,8,9,11)
InChIKeyGVWALDUEYDNXOO-UHFFFAOYSA-N
XLogP0.33
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.15
LogP ≤ 50.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-Fluoro-6-[(2-aminoimidazol-1-yl)methyl]uracil
CID 44632008
6-[(2-amino-1H-imidazol-3-ium-3-yl)methyl]-1H-pyrimidine-2,4-dione chloride
CID 11746845
2-Amino-1-(2,6-dioxo-1,2,3,6-tetrahydro-pyrimidin-4-ylmethyl)-3H-imidazol-1-ium; chloride
CID 11746846
5-fluoro-6-(imidazol-1-ylmethyl)-1H-pyrimidine-2,4-dione
CID 46880481
6-[(2-nitroimidazol-1-yl)methyl]-1H-pyrimidine-2,4-dione
CID 10955570
2-Oxo-ethenoguanine
CID 172879900
Imidazo[1,2-a]pyrimidine-5,7-diol
CID 13465980
4-Amino-1-(2,6-dioxo-1,2,3,6-tetrahydro-pyrimidin-4-ylmethyl)-3H-imidazol-1-ium
CID 11334014
2-((3-(1H-imidazol-1-yl)propyl)amino)-6-methylpyrimidin-4-ol
CID 135611993
Imidazo[1,2-a]pyrimidin-7(8h)-one
CID 14258107
2-Methylimidazo[1,5-a]pyrimidin-4(1H)-one
CID 45082880
5H-Imidazo[1,5-a]pyrimidinone
CID 129629689

Frequently Asked Questions

What is the IUPAC name of 5-methyl-8H-imidazo[1,2-a]pyrimidin-7-one?
The IUPAC name of 5-methyl-8H-imidazo[1,2-a]pyrimidin-7-one (CID 76849717) is 5-methyl-8H-imidazo[1,2-a]pyrimidin-7-one.
What is the SMILES notation for 5-methyl-8H-imidazo[1,2-a]pyrimidin-7-one?
The canonical SMILES for 5-methyl-8H-imidazo[1,2-a]pyrimidin-7-one is Cc1cc(=O)[nH]c2nccn12.
What is the InChIKey of 5-methyl-8H-imidazo[1,2-a]pyrimidin-7-one?
The InChIKey is GVWALDUEYDNXOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7N3O/c1-5-4-6(11)9-7-8-2-3-10(5)7/h2-4H,1H3,(H,8,9,11).
What are the key properties of 5-methyl-8H-imidazo[1,2-a]pyrimidin-7-one?
5-methyl-8H-imidazo[1,2-a]pyrimidin-7-one has a molecular weight of 149.15 g/mol, XLogP of 0.33, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-8H-imidazo[1,2-a]pyrimidin-7-one is sourced from PubChem (CID 76849717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).