8-(2-chlorophenyl)-6H-imidazo[1,2-c]pyrimidin-5-one

C12H8ClN3O — CID 171343023

IUPAC8-(2-chlorophenyl)-6H-imidazo[1,2-c]pyrimidin-5-one
SMILESO=c1[nH]cc(-c2ccccc2Cl)c2nccn12
InChIInChI=1S/C12H8ClN3O/c13-10-4-2-1-3-8(10)9-7-15-12(17)16-6-5-14-11(9)16/h1-7H,(H,15,17)
InChIKeyJHYABFQNNRVDEH-UHFFFAOYSA-N
MW245.67 g/mol
LogP2.34
Rot. Bonds1

About 8-(2-chlorophenyl)-6H-imidazo[1,2-c]pyrimidin-5-one

8-(2-chlorophenyl)-6H-imidazo[1,2-c]pyrimidin-5-one (PubChem CID 171343023) has the molecular formula C12H8ClN3O and a molecular weight of 245.67 g/mol. Its IUPAC name is 8-(2-chlorophenyl)-6H-imidazo[1,2-c]pyrimidin-5-one.

Molecular Properties

Compound Name8-(2-chlorophenyl)-6H-imidazo[1,2-c]pyrimidin-5-one
PubChem CID171343023
Molecular FormulaC12H8ClN3O
Molecular Weight245.67 g/mol
Exact Mass245.04
IUPAC Name8-(2-chlorophenyl)-6H-imidazo[1,2-c]pyrimidin-5-one
SMILESO=c1[nH]cc(-c2ccccc2Cl)c2nccn12
InChIInChI=1S/C12H8ClN3O/c13-10-4-2-1-3-8(10)9-7-15-12(17)16-6-5-14-11(9)16/h1-7H,(H,15,17)
InChIKeyJHYABFQNNRVDEH-UHFFFAOYSA-N
XLogP2.34
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.67
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(2-Chloro-phenyl)-N-(3-imidazol-1-yl-propyl)-acrylamide
CID 5766212
3-(2,6-dichlorophenyl)-N-[3-(1H-imidazol-1-yl)propyl]acrylamide
CID 5736722
2-(2-chloro-6-fluorophenyl)-N-(3-imidazol-1-ylpropyl)acetamide
CID 2963113
2-[(2,6-dichlorophenyl)methyl]-1H-imidazole
CID 18954858
2-(2-chlorophenyl)-N-(3-imidazol-1-ylpropyl)acetamide
CID 2970578
3-[2-(3-chlorophenyl)-1H-imidazol-1-yl]pyridin-2-ol
CID 70773823
2-(3-chlorophenyl)-8-iodo-6H-imidazo[1,2-c]pyrimidin-5-one
CID 136027071
8-phenyl-6H-imidazo[1,2-c]pyrimidin-5-one
CID 139228084
N-(2-phenylethyl)-1H-imidazole-1-carboxamide
CID 10751166
2-(2-chlorophenyl)-1H-imidazole
CID 12622722
9-chloro-5H, 10H-imidazo [1,2-a]indeno[1,2-e]pyrazin-4-one
CID 44370129
5-[1-[(2-Chlorophenyl)methyl]imidazol-2-yl]-1,3-dimethylpyridin-2-one
CID 134306285

Frequently Asked Questions

What is the IUPAC name of 8-(2-chlorophenyl)-6H-imidazo[1,2-c]pyrimidin-5-one?
The IUPAC name of 8-(2-chlorophenyl)-6H-imidazo[1,2-c]pyrimidin-5-one (CID 171343023) is 8-(2-chlorophenyl)-6H-imidazo[1,2-c]pyrimidin-5-one.
What is the SMILES notation for 8-(2-chlorophenyl)-6H-imidazo[1,2-c]pyrimidin-5-one?
The canonical SMILES for 8-(2-chlorophenyl)-6H-imidazo[1,2-c]pyrimidin-5-one is O=c1[nH]cc(-c2ccccc2Cl)c2nccn12.
What is the InChIKey of 8-(2-chlorophenyl)-6H-imidazo[1,2-c]pyrimidin-5-one?
The InChIKey is JHYABFQNNRVDEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8ClN3O/c13-10-4-2-1-3-8(10)9-7-15-12(17)16-6-5-14-11(9)16/h1-7H,(H,15,17).
What are the key properties of 8-(2-chlorophenyl)-6H-imidazo[1,2-c]pyrimidin-5-one?
8-(2-chlorophenyl)-6H-imidazo[1,2-c]pyrimidin-5-one has a molecular weight of 245.67 g/mol, XLogP of 2.34, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(2-chlorophenyl)-6H-imidazo[1,2-c]pyrimidin-5-one is sourced from PubChem (CID 171343023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).