6,7-dimethyl-3H-imidazo[1,2-a]pyrimidin-5-one

C8H9N3O — CID 22373740

IUPAC6,7-dimethyl-3H-imidazo[1,2-a]pyrimidin-5-one
SMILESCc1nc2n(c(=O)c1C)CC=N2
InChIInChI=1S/C8H9N3O/c1-5-6(2)10-8-9-3-4-11(8)7(5)12/h3H,4H2,1-2H3
InChIKeyUHNZEGJGENHEEG-UHFFFAOYSA-N
MW163.18 g/mol
LogP0.58
Rot. Bonds

About 6,7-dimethyl-3H-imidazo[1,2-a]pyrimidin-5-one

6,7-dimethyl-3H-imidazo[1,2-a]pyrimidin-5-one (PubChem CID 22373740) has the molecular formula C8H9N3O and a molecular weight of 163.18 g/mol. Its IUPAC name is 6,7-dimethyl-3H-imidazo[1,2-a]pyrimidin-5-one.

Molecular Properties

Compound Name6,7-dimethyl-3H-imidazo[1,2-a]pyrimidin-5-one
PubChem CID22373740
Molecular FormulaC8H9N3O
Molecular Weight163.18 g/mol
Exact Mass163.07
IUPAC Name6,7-dimethyl-3H-imidazo[1,2-a]pyrimidin-5-one
SMILESCc1nc2n(c(=O)c1C)CC=N2
InChIInChI=1S/C8H9N3O/c1-5-6(2)10-8-9-3-4-11(8)7(5)12/h3H,4H2,1-2H3
InChIKeyUHNZEGJGENHEEG-UHFFFAOYSA-N
XLogP0.58
TPSA47.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.18
LogP ≤ 50.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-3-ethyl-5,6-dimethylpyrimidin-4(3H)-one
CID 641973
2,3,5,6-Tetramethylpyrimidin-4-one
CID 13149275
3-Ethyl-2,5,6-trimethylpyrimidin-4-one
CID 22091870
6-ethyl-7-methyl-3H-imidazo[1,2-a]pyrimidin-5-one
CID 22373707
6-Isopropyl-7-methylimidazo[1,2-a]pyrimidin-5-one
CID 22373725
2,3,7,8-tetramethyl-6H-pyrrolo[1,2-a]pyrimidin-4-one
CID 59119712
3-Ethyl-5,6-dimethylpyrimidin-4-one
CID 130630340
5,6-Dimethyl-3-propylpyrimidin-4-one
CID 131175563
2-Amino-5,6-dimethyl-3-propylpyrimidin-4-one;ethane
CID 145440011
5,6-Dimethyl-3-propan-2-ylpyrimidin-4-one
CID 166530387
2-Amino-5,6-dimethyl-3-propylpyrimidin-4-one;ethane
CID 176554793
2-Amino-5,6-dimethyl-3-propylpyrimidin-4-one
CID 145440012

Frequently Asked Questions

What is the IUPAC name of 6,7-dimethyl-3H-imidazo[1,2-a]pyrimidin-5-one?
The IUPAC name of 6,7-dimethyl-3H-imidazo[1,2-a]pyrimidin-5-one (CID 22373740) is 6,7-dimethyl-3H-imidazo[1,2-a]pyrimidin-5-one.
What is the SMILES notation for 6,7-dimethyl-3H-imidazo[1,2-a]pyrimidin-5-one?
The canonical SMILES for 6,7-dimethyl-3H-imidazo[1,2-a]pyrimidin-5-one is Cc1nc2n(c(=O)c1C)CC=N2.
What is the InChIKey of 6,7-dimethyl-3H-imidazo[1,2-a]pyrimidin-5-one?
The InChIKey is UHNZEGJGENHEEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N3O/c1-5-6(2)10-8-9-3-4-11(8)7(5)12/h3H,4H2,1-2H3.
What are the key properties of 6,7-dimethyl-3H-imidazo[1,2-a]pyrimidin-5-one?
6,7-dimethyl-3H-imidazo[1,2-a]pyrimidin-5-one has a molecular weight of 163.18 g/mol, XLogP of 0.58, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-dimethyl-3H-imidazo[1,2-a]pyrimidin-5-one is sourced from PubChem (CID 22373740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).