6,8-dichloro-2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridine

C18H17Cl2FN4 — CID 19367112

IUPAC6,8-dichloro-2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridine
SMILESFc1ccc(N2CCN(Cc3cn4cc(Cl)cc(Cl)c4n3)CC2)cc1
InChIInChI=1S/C18H17Cl2FN4/c19-13-9-17(20)18-22-15(12-25(18)10-13)11-23-5-7-24(8-6-23)16-3-1-14(21)2-4-16/h1-4,9-10,12H,5-8,11H2
InChIKeyBUJACYDNJRCKQM-UHFFFAOYSA-N
MW379.27 g/mol
LogP4.10
Rot. Bonds3

About 6,8-dichloro-2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridine

6,8-dichloro-2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridine (PubChem CID 19367112) has the molecular formula C18H17Cl2FN4 and a molecular weight of 379.27 g/mol. Its IUPAC name is 6,8-dichloro-2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name6,8-dichloro-2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridine
PubChem CID19367112
Molecular FormulaC18H17Cl2FN4
Molecular Weight379.27 g/mol
Exact Mass378.08
IUPAC Name6,8-dichloro-2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridine
SMILESFc1ccc(N2CCN(Cc3cn4cc(Cl)cc(Cl)c4n3)CC2)cc1
InChIInChI=1S/C18H17Cl2FN4/c19-13-9-17(20)18-22-15(12-25(18)10-13)11-23-5-7-24(8-6-23)16-3-1-14(21)2-4-16/h1-4,9-10,12H,5-8,11H2
InChIKeyBUJACYDNJRCKQM-UHFFFAOYSA-N
XLogP4.10
TPSA23.78 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.27
LogP ≤ 54.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6,8-dichloro-2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridine?
The IUPAC name of 6,8-dichloro-2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridine (CID 19367112) is 6,8-dichloro-2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridine.
What is the SMILES notation for 6,8-dichloro-2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridine?
The canonical SMILES for 6,8-dichloro-2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridine is Fc1ccc(N2CCN(Cc3cn4cc(Cl)cc(Cl)c4n3)CC2)cc1.
What is the InChIKey of 6,8-dichloro-2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridine?
The InChIKey is BUJACYDNJRCKQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17Cl2FN4/c19-13-9-17(20)18-22-15(12-25(18)10-13)11-23-5-7-24(8-6-23)16-3-1-14(21)2-4-16/h1-4,9-10,12H,5-8,11H2.
What are the key properties of 6,8-dichloro-2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridine?
6,8-dichloro-2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridine has a molecular weight of 379.27 g/mol, XLogP of 4.10, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6,8-dichloro-2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridine is sourced from PubChem (CID 19367112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).