2-(3,4-dichlorophenyl)-5,7-dimethylimidazo[1,2-a]pyrimidine

C14H11Cl2N3 — CID 115281793

IUPAC2-(3,4-dichlorophenyl)-5,7-dimethylimidazo[1,2-a]pyrimidine
SMILESCc1cc(C)n2cc(-c3ccc(Cl)c(Cl)c3)nc2n1
InChIInChI=1S/C14H11Cl2N3/c1-8-5-9(2)19-7-13(18-14(19)17-8)10-3-4-11(15)12(16)6-10/h3-7H,1-2H3
InChIKeyZHFKEPOQEKWFKW-UHFFFAOYSA-N
MW292.17 g/mol
LogP4.32
Rot. Bonds1

About 2-(3,4-dichlorophenyl)-5,7-dimethylimidazo[1,2-a]pyrimidine

2-(3,4-dichlorophenyl)-5,7-dimethylimidazo[1,2-a]pyrimidine (PubChem CID 115281793) has the molecular formula C14H11Cl2N3 and a molecular weight of 292.17 g/mol. Its IUPAC name is 2-(3,4-dichlorophenyl)-5,7-dimethylimidazo[1,2-a]pyrimidine.

Molecular Properties

Compound Name2-(3,4-dichlorophenyl)-5,7-dimethylimidazo[1,2-a]pyrimidine
PubChem CID115281793
Molecular FormulaC14H11Cl2N3
Molecular Weight292.17 g/mol
Exact Mass291.03
IUPAC Name2-(3,4-dichlorophenyl)-5,7-dimethylimidazo[1,2-a]pyrimidine
SMILESCc1cc(C)n2cc(-c3ccc(Cl)c(Cl)c3)nc2n1
InChIInChI=1S/C14H11Cl2N3/c1-8-5-9(2)19-7-13(18-14(19)17-8)10-3-4-11(15)12(16)6-10/h3-7H,1-2H3
InChIKeyZHFKEPOQEKWFKW-UHFFFAOYSA-N
XLogP4.32
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.17
LogP ≤ 54.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-fluoro-4-methylphenyl)-5,7-dimethylimidazo[1,2-a]pyrimidine
CID 115404395
5,7-dimethyl-2-pyridin-4-ylimidazo[1,2-a]pyrimidine
CID 115404398
2-(5-bromofuran-2-yl)-5,7-dimethylimidazo[1,2-a]pyrimidine
CID 104654247
5-[4-(2-chlorophenyl)piperazin-1-yl]-7-methyl-2-phenylimidazo[1,2-a]pyrimidine
CID 1472745
6-(3-chloro-4-fluorophenyl)-3-methylimidazo[2,1-b][1,3]thiazole
CID 115403389
(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methanethiol
CID 87896349
6-bromo-2-(3,4-dichlorophenyl)-8-methylimidazo[1,2-a]pyridine
CID 46307191
2-chloro-4-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methylsulfanyl]aniline
CID 79131278
8-(3,4-dichlorophenyl)-2-methyl-6-phenylimidazo[1,2-a]pyrazin-3-ol
CID 177392581
5,7-dimethyl-2-[(4-phenyl-1-propylimidazol-2-yl)sulfanylmethyl]imidazo[1,2-a]pyrimidine
CID 44548778
6-bromo-2-(3-chloro-4-fluorophenyl)-5-methylimidazo[1,2-a]pyridine
CID 115403666
2-chloro-4-(3-chloro-4-methylphenyl)-6-methylpyrimidine
CID 115504189

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dichlorophenyl)-5,7-dimethylimidazo[1,2-a]pyrimidine?
The IUPAC name of 2-(3,4-dichlorophenyl)-5,7-dimethylimidazo[1,2-a]pyrimidine (CID 115281793) is 2-(3,4-dichlorophenyl)-5,7-dimethylimidazo[1,2-a]pyrimidine.
What is the SMILES notation for 2-(3,4-dichlorophenyl)-5,7-dimethylimidazo[1,2-a]pyrimidine?
The canonical SMILES for 2-(3,4-dichlorophenyl)-5,7-dimethylimidazo[1,2-a]pyrimidine is Cc1cc(C)n2cc(-c3ccc(Cl)c(Cl)c3)nc2n1.
What is the InChIKey of 2-(3,4-dichlorophenyl)-5,7-dimethylimidazo[1,2-a]pyrimidine?
The InChIKey is ZHFKEPOQEKWFKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11Cl2N3/c1-8-5-9(2)19-7-13(18-14(19)17-8)10-3-4-11(15)12(16)6-10/h3-7H,1-2H3.
What are the key properties of 2-(3,4-dichlorophenyl)-5,7-dimethylimidazo[1,2-a]pyrimidine?
2-(3,4-dichlorophenyl)-5,7-dimethylimidazo[1,2-a]pyrimidine has a molecular weight of 292.17 g/mol, XLogP of 4.32, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dichlorophenyl)-5,7-dimethylimidazo[1,2-a]pyrimidine is sourced from PubChem (CID 115281793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).