5-[4-(4-chlorophenyl)piperazin-1-yl]-7-(3,4-dimethoxyphenyl)imidazo[1,2-c]pyrimidine

C24H24ClN5O2 — CID 20805768

IUPAC5-[4-(4-chlorophenyl)piperazin-1-yl]-7-(3,4-dimethoxyphenyl)imidazo[1,2-c]pyrimidine
SMILESCOc1ccc(-c2cc3nccn3c(N3CCN(c4ccc(Cl)cc4)CC3)n2)cc1OC
InChIInChI=1S/C24H24ClN5O2/c1-31-21-8-3-17(15-22(21)32-2)20-16-23-26-9-10-30(23)24(27-20)29-13-11-28(12-14-29)19-6-4-18(25)5-7-19/h3-10,15-16H,11-14H2,1-2H3
InChIKeyLYIZFCAQXHWADW-UHFFFAOYSA-N
MW449.94 g/mol
LogP4.39
Rot. Bonds5

About 5-[4-(4-chlorophenyl)piperazin-1-yl]-7-(3,4-dimethoxyphenyl)imidazo[1,2-c]pyrimidine

5-[4-(4-chlorophenyl)piperazin-1-yl]-7-(3,4-dimethoxyphenyl)imidazo[1,2-c]pyrimidine (PubChem CID 20805768) has the molecular formula C24H24ClN5O2 and a molecular weight of 449.94 g/mol. Its IUPAC name is 5-[4-(4-chlorophenyl)piperazin-1-yl]-7-(3,4-dimethoxyphenyl)imidazo[1,2-c]pyrimidine.

Molecular Properties

Compound Name5-[4-(4-chlorophenyl)piperazin-1-yl]-7-(3,4-dimethoxyphenyl)imidazo[1,2-c]pyrimidine
PubChem CID20805768
Molecular FormulaC24H24ClN5O2
Molecular Weight449.94 g/mol
Exact Mass449.16
IUPAC Name5-[4-(4-chlorophenyl)piperazin-1-yl]-7-(3,4-dimethoxyphenyl)imidazo[1,2-c]pyrimidine
SMILESCOc1ccc(-c2cc3nccn3c(N3CCN(c4ccc(Cl)cc4)CC3)n2)cc1OC
InChIInChI=1S/C24H24ClN5O2/c1-31-21-8-3-17(15-22(21)32-2)20-16-23-26-9-10-30(23)24(27-20)29-13-11-28(12-14-29)19-6-4-18(25)5-7-19/h3-10,15-16H,11-14H2,1-2H3
InChIKeyLYIZFCAQXHWADW-UHFFFAOYSA-N
XLogP4.39
TPSA55.13 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500449.94
LogP ≤ 54.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

7-(3,4-dimethoxyphenyl)-5-[4-(4-methylphenyl)piperazin-1-yl]imidazo[1,2-c]pyrimidine
CID 20805928
methyl 1-[7-(3,4-dimethoxyphenyl)imidazo[1,2-c]pyrimidin-5-yl]piperidine-4-carboxylate
CID 20806107
4-[7-(3,4-dimethoxyphenyl)imidazo[1,2-c]pyrimidin-5-yl]sulfanylaniline
CID 20806044
[4-(4-chlorophenyl)piperazin-1-yl]-[2-(3,4-dimethoxyphenyl)quinolin-4-yl]methanone
CID 4535152
2-[4-[7-(3,4-dimethoxyphenyl)imidazo[1,2-c]pyrimidin-5-yl]sulfanylphenyl]sulfanylacetic acid
CID 20805767
N-(3,5-difluorophenyl)-7-(3,4-dimethoxyphenyl)imidazo[1,2-c]pyrimidin-5-amine
CID 20806138
5-[[7-(3,4-dimethoxyphenyl)imidazo[1,2-c]pyrimidin-5-yl]amino]-2-methoxyphenol
CID 20806083
4-[3-[5-(5-ethylsulfanylimidazo[1,2-c]pyrimidin-7-yl)-2-methoxyphenoxy]propyl]morpholine
CID 20805814
7-[4-(2-chloroethoxy)-3-methoxyphenyl]-5-ethylsulfanylimidazo[1,2-c]pyrimidine;4-[2-[4-(5-ethylsulfanylimidazo[1,2-c]pyrimidin-7-yl)-2-methoxyphenoxy]ethyl]morpholine
CID 158602757
7-(3,4-dimethoxyphenyl)-N-(4-propan-2-yloxyphenyl)imidazo[1,2-c]pyrimidin-5-amine
CID 20805975
4-(5-ethylsulfanylimidazo[1,2-c]pyrimidin-7-yl)-2-methoxy-N,N-dimethylaniline
CID 20805883
3-[4-[7-(3,4-dimethoxyphenyl)imidazo[1,2-c]pyrimidin-5-yl]sulfanylphenyl]-N,N-dimethylpropanamide
CID 20805860

Frequently Asked Questions

What is the IUPAC name of 5-[4-(4-chlorophenyl)piperazin-1-yl]-7-(3,4-dimethoxyphenyl)imidazo[1,2-c]pyrimidine?
The IUPAC name of 5-[4-(4-chlorophenyl)piperazin-1-yl]-7-(3,4-dimethoxyphenyl)imidazo[1,2-c]pyrimidine (CID 20805768) is 5-[4-(4-chlorophenyl)piperazin-1-yl]-7-(3,4-dimethoxyphenyl)imidazo[1,2-c]pyrimidine.
What is the SMILES notation for 5-[4-(4-chlorophenyl)piperazin-1-yl]-7-(3,4-dimethoxyphenyl)imidazo[1,2-c]pyrimidine?
The canonical SMILES for 5-[4-(4-chlorophenyl)piperazin-1-yl]-7-(3,4-dimethoxyphenyl)imidazo[1,2-c]pyrimidine is COc1ccc(-c2cc3nccn3c(N3CCN(c4ccc(Cl)cc4)CC3)n2)cc1OC.
What is the InChIKey of 5-[4-(4-chlorophenyl)piperazin-1-yl]-7-(3,4-dimethoxyphenyl)imidazo[1,2-c]pyrimidine?
The InChIKey is LYIZFCAQXHWADW-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24ClN5O2/c1-31-21-8-3-17(15-22(21)32-2)20-16-23-26-9-10-30(23)24(27-20)29-13-11-28(12-14-29)19-6-4-18(25)5-7-19/h3-10,15-16H,11-14H2,1-2H3.
What are the key properties of 5-[4-(4-chlorophenyl)piperazin-1-yl]-7-(3,4-dimethoxyphenyl)imidazo[1,2-c]pyrimidine?
5-[4-(4-chlorophenyl)piperazin-1-yl]-7-(3,4-dimethoxyphenyl)imidazo[1,2-c]pyrimidine has a molecular weight of 449.94 g/mol, XLogP of 4.39, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[4-(4-chlorophenyl)piperazin-1-yl]-7-(3,4-dimethoxyphenyl)imidazo[1,2-c]pyrimidine is sourced from PubChem (CID 20805768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).