6-bromo-2-ethyl-N-[[4-(4-fluorophenyl)-1,3-thiazol-2-yl]methyl]imidazo[1,2-a]pyrazin-3-amine

C18H15BrFN5S — CID 122422214

IUPAC6-bromo-2-ethyl-N-[[4-(4-fluorophenyl)-1,3-thiazol-2-yl]methyl]imidazo[1,2-a]pyrazin-3-amine
SMILESCCc1nc2cnc(Br)cn2c1NCc1nc(-c2ccc(F)cc2)cs1
InChIInChI=1S/C18H15BrFN5S/c1-2-13-18(25-9-15(19)21-7-16(25)23-13)22-8-17-24-14(10-26-17)11-3-5-12(20)6-4-11/h3-7,9-10,22H,2,8H2,1H3
InChIKeyREZKTVVAPJANJR-UHFFFAOYSA-N
MW432.32 g/mol
LogP4.93
Rot. Bonds5

About 6-bromo-2-ethyl-N-[[4-(4-fluorophenyl)-1,3-thiazol-2-yl]methyl]imidazo[1,2-a]pyrazin-3-amine

6-bromo-2-ethyl-N-[[4-(4-fluorophenyl)-1,3-thiazol-2-yl]methyl]imidazo[1,2-a]pyrazin-3-amine (PubChem CID 122422214) has the molecular formula C18H15BrFN5S and a molecular weight of 432.32 g/mol. Its IUPAC name is 6-bromo-2-ethyl-N-[[4-(4-fluorophenyl)-1,3-thiazol-2-yl]methyl]imidazo[1,2-a]pyrazin-3-amine.

Molecular Properties

Compound Name6-bromo-2-ethyl-N-[[4-(4-fluorophenyl)-1,3-thiazol-2-yl]methyl]imidazo[1,2-a]pyrazin-3-amine
PubChem CID122422214
Molecular FormulaC18H15BrFN5S
Molecular Weight432.32 g/mol
Exact Mass431.02
IUPAC Name6-bromo-2-ethyl-N-[[4-(4-fluorophenyl)-1,3-thiazol-2-yl]methyl]imidazo[1,2-a]pyrazin-3-amine
SMILESCCc1nc2cnc(Br)cn2c1NCc1nc(-c2ccc(F)cc2)cs1
InChIInChI=1S/C18H15BrFN5S/c1-2-13-18(25-9-15(19)21-7-16(25)23-13)22-8-17-24-14(10-26-17)11-3-5-12(20)6-4-11/h3-7,9-10,22H,2,8H2,1H3
InChIKeyREZKTVVAPJANJR-UHFFFAOYSA-N
XLogP4.93
TPSA55.11 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500432.32
LogP ≤ 54.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 6-bromo-2-ethyl-N-[[4-(4-fluorophenyl)-1,3-thiazol-2-yl]methyl]imidazo[1,2-a]pyrazin-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-ethyl-N-[[4-(4-fluorophenyl)-1,3-thiazol-2-yl]methyl]-6-(1,2,3,6-tetrahydropyridin-4-yl)imidazo[1,2-b]pyridazin-3-amine
CID 140869449
N-ethyl-4-(4-fluorophenyl)-1,3-thiazol-2-amine
CID 1132723
N-[2-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]ethyl]propan-1-amine
CID 82103158
6-bromo-3-(4-fluorophenyl)imidazo[1,2-a]pyrazine
CID 89429108
N-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]methyl]propan-1-amine
CID 55129658
N-(2-ethyl-6-iodoimidazo[1,2-a]pyridin-3-yl)-4-(4-fluorophenyl)-N-methyl-1,3-thiazol-2-amine
CID 90446713
N-[[4-(4-fluorophenyl)-1,3-thiazol-2-yl]methyl]-2-methylpyrazole-3-carboxamide
CID 131931773
1-[2-ethyl-3-[[4-(4-fluorophenyl)-1,3-thiazol-2-yl]methyl-methylamino]imidazo[1,2-a]pyridin-6-yl]piperidin-4-ol
CID 134173508
2-methyl-N-[[4-(4-propoxyphenyl)-1,3-thiazol-2-yl]methyl]propan-2-amine
CID 62545171
2-(2-chloroethyl)-4-(4-fluorophenyl)-1,3-thiazole
CID 82117610
N-[[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]methyl]-2-methylpropan-2-amine
CID 62542712
N-[2-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]ethyl]propan-2-amine
CID 82103269

Frequently Asked Questions

What is the IUPAC name of 6-bromo-2-ethyl-N-[[4-(4-fluorophenyl)-1,3-thiazol-2-yl]methyl]imidazo[1,2-a]pyrazin-3-amine?
The IUPAC name of 6-bromo-2-ethyl-N-[[4-(4-fluorophenyl)-1,3-thiazol-2-yl]methyl]imidazo[1,2-a]pyrazin-3-amine (CID 122422214) is 6-bromo-2-ethyl-N-[[4-(4-fluorophenyl)-1,3-thiazol-2-yl]methyl]imidazo[1,2-a]pyrazin-3-amine.
What is the SMILES notation for 6-bromo-2-ethyl-N-[[4-(4-fluorophenyl)-1,3-thiazol-2-yl]methyl]imidazo[1,2-a]pyrazin-3-amine?
The canonical SMILES for 6-bromo-2-ethyl-N-[[4-(4-fluorophenyl)-1,3-thiazol-2-yl]methyl]imidazo[1,2-a]pyrazin-3-amine is CCc1nc2cnc(Br)cn2c1NCc1nc(-c2ccc(F)cc2)cs1.
What is the InChIKey of 6-bromo-2-ethyl-N-[[4-(4-fluorophenyl)-1,3-thiazol-2-yl]methyl]imidazo[1,2-a]pyrazin-3-amine?
The InChIKey is REZKTVVAPJANJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15BrFN5S/c1-2-13-18(25-9-15(19)21-7-16(25)23-13)22-8-17-24-14(10-26-17)11-3-5-12(20)6-4-11/h3-7,9-10,22H,2,8H2,1H3.
What are the key properties of 6-bromo-2-ethyl-N-[[4-(4-fluorophenyl)-1,3-thiazol-2-yl]methyl]imidazo[1,2-a]pyrazin-3-amine?
6-bromo-2-ethyl-N-[[4-(4-fluorophenyl)-1,3-thiazol-2-yl]methyl]imidazo[1,2-a]pyrazin-3-amine has a molecular weight of 432.32 g/mol, XLogP of 4.93, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-2-ethyl-N-[[4-(4-fluorophenyl)-1,3-thiazol-2-yl]methyl]imidazo[1,2-a]pyrazin-3-amine is sourced from PubChem (CID 122422214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).