[5-[[[1-(2-methoxyethyl)piperidin-4-yl]methyl-methylamino]methyl]imidazo[2,1-b][1,3]thiazol-6-yl]-piperidin-1-ylmethanone

C22H35N5O2S — CID 42290230

IUPAC[5-[[[1-(2-methoxyethyl)piperidin-4-yl]methyl-methylamino]methyl]imidazo[2,1-b][1,3]thiazol-6-yl]-piperidin-1-ylmethanone
SMILESCOCCN1CCC(CN(C)Cc2c(C(=O)N3CCCCC3)nc3sccn23)CC1
InChIInChI=1S/C22H35N5O2S/c1-24(16-18-6-10-25(11-7-18)12-14-29-2)17-19-20(23-22-27(19)13-15-30-22)21(28)26-8-4-3-5-9-26/h13,15,18H,3-12,14,16-17H2,1-2H3
InChIKeyMVNDVBQSBOIERJ-UHFFFAOYSA-N
MW433.62 g/mol
LogP2.81
Rot. Bonds8

About [5-[[[1-(2-methoxyethyl)piperidin-4-yl]methyl-methylamino]methyl]imidazo[2,1-b][1,3]thiazol-6-yl]-piperidin-1-ylmethanone

[5-[[[1-(2-methoxyethyl)piperidin-4-yl]methyl-methylamino]methyl]imidazo[2,1-b][1,3]thiazol-6-yl]-piperidin-1-ylmethanone (PubChem CID 42290230) has the molecular formula C22H35N5O2S and a molecular weight of 433.62 g/mol. Its IUPAC name is [5-[[[1-(2-methoxyethyl)piperidin-4-yl]methyl-methylamino]methyl]imidazo[2,1-b][1,3]thiazol-6-yl]-piperidin-1-ylmethanone.

Molecular Properties

Compound Name[5-[[[1-(2-methoxyethyl)piperidin-4-yl]methyl-methylamino]methyl]imidazo[2,1-b][1,3]thiazol-6-yl]-piperidin-1-ylmethanone
PubChem CID42290230
Molecular FormulaC22H35N5O2S
Molecular Weight433.62 g/mol
Exact Mass433.25
IUPAC Name[5-[[[1-(2-methoxyethyl)piperidin-4-yl]methyl-methylamino]methyl]imidazo[2,1-b][1,3]thiazol-6-yl]-piperidin-1-ylmethanone
SMILESCOCCN1CCC(CN(C)Cc2c(C(=O)N3CCCCC3)nc3sccn23)CC1
InChIInChI=1S/C22H35N5O2S/c1-24(16-18-6-10-25(11-7-18)12-14-29-2)17-19-20(23-22-27(19)13-15-30-22)21(28)26-8-4-3-5-9-26/h13,15,18H,3-12,14,16-17H2,1-2H3
InChIKeyMVNDVBQSBOIERJ-UHFFFAOYSA-N
XLogP2.81
TPSA53.32 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500433.62
LogP ≤ 52.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze [5-[[[1-(2-methoxyethyl)piperidin-4-yl]methyl-methylamino]methyl]imidazo[2,1-b][1,3]thiazol-6-yl]-piperidin-1-ylmethanone 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

azocan-1-yl-[5-[[methyl-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]amino]methyl]imidazo[2,1-b][1,3]thiazol-6-yl]methanone
CID 30852089
[5-[[cyclobutylmethyl(oxolan-2-ylmethyl)amino]methyl]imidazo[2,1-b][1,3]thiazol-6-yl]-(4-methyl-1,4-diazepan-1-yl)methanone
CID 45200191
[5-[[methyl-[(5-phenyl-1,2-oxazol-3-yl)methyl]amino]methyl]imidazo[2,1-b][1,3]thiazol-6-yl]-pyrrolidin-1-ylmethanone
CID 28783501
azocan-1-yl-[5-[[(3S)-3-hydroxypiperidin-1-yl]methyl]imidazo[2,1-b][1,3]thiazol-6-yl]methanone
CID 42291044
piperidin-1-yl-[5-(thiomorpholin-4-ylmethyl)imidazo[2,1-b][1,3]thiazol-6-yl]methanone
CID 31005446
[5-[(3-hydroxypiperidin-1-yl)methyl]imidazo[2,1-b][1,3]thiazol-6-yl]-pyrrolidin-1-ylmethanone
CID 56878530
[5-[[3-(4-fluorophenyl)pyrrolidin-1-yl]methyl]imidazo[2,1-b][1,3]thiazol-6-yl]-piperidin-1-ylmethanone
CID 45182768
[5-[[methyl-[(3-methyl-1H-indol-2-yl)methyl]amino]methyl]imidazo[2,1-b][1,3]thiazol-6-yl]-pyrrolidin-1-ylmethanone
CID 42289174
[5-[[ethyl(2-pyrazol-1-ylethyl)amino]methyl]imidazo[2,1-b][1,3]thiazol-6-yl]-(4-methyl-1,4-diazepan-1-yl)methanone
CID 28641621
[5-[[3-(2-chlorophenyl)pyrrolidin-1-yl]methyl]imidazo[2,1-b][1,3]thiazol-6-yl]-piperidin-1-ylmethanone
CID 45178972
azocan-1-yl-[5-[(2-methylsulfanylethylamino)methyl]imidazo[2,1-b][1,3]thiazol-6-yl]methanone
CID 45176633
azocan-1-yl-[5-[[2-(4-methyl-1,2,5-oxadiazol-3-yl)pyrrolidin-1-yl]methyl]imidazo[2,1-b][1,3]thiazol-6-yl]methanone
CID 45182905

Frequently Asked Questions

What is the IUPAC name of [5-[[[1-(2-methoxyethyl)piperidin-4-yl]methyl-methylamino]methyl]imidazo[2,1-b][1,3]thiazol-6-yl]-piperidin-1-ylmethanone?
The IUPAC name of [5-[[[1-(2-methoxyethyl)piperidin-4-yl]methyl-methylamino]methyl]imidazo[2,1-b][1,3]thiazol-6-yl]-piperidin-1-ylmethanone (CID 42290230) is [5-[[[1-(2-methoxyethyl)piperidin-4-yl]methyl-methylamino]methyl]imidazo[2,1-b][1,3]thiazol-6-yl]-piperidin-1-ylmethanone.
What is the SMILES notation for [5-[[[1-(2-methoxyethyl)piperidin-4-yl]methyl-methylamino]methyl]imidazo[2,1-b][1,3]thiazol-6-yl]-piperidin-1-ylmethanone?
The canonical SMILES for [5-[[[1-(2-methoxyethyl)piperidin-4-yl]methyl-methylamino]methyl]imidazo[2,1-b][1,3]thiazol-6-yl]-piperidin-1-ylmethanone is COCCN1CCC(CN(C)Cc2c(C(=O)N3CCCCC3)nc3sccn23)CC1.
What is the InChIKey of [5-[[[1-(2-methoxyethyl)piperidin-4-yl]methyl-methylamino]methyl]imidazo[2,1-b][1,3]thiazol-6-yl]-piperidin-1-ylmethanone?
The InChIKey is MVNDVBQSBOIERJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H35N5O2S/c1-24(16-18-6-10-25(11-7-18)12-14-29-2)17-19-20(23-22-27(19)13-15-30-22)21(28)26-8-4-3-5-9-26/h13,15,18H,3-12,14,16-17H2,1-2H3.
What are the key properties of [5-[[[1-(2-methoxyethyl)piperidin-4-yl]methyl-methylamino]methyl]imidazo[2,1-b][1,3]thiazol-6-yl]-piperidin-1-ylmethanone?
[5-[[[1-(2-methoxyethyl)piperidin-4-yl]methyl-methylamino]methyl]imidazo[2,1-b][1,3]thiazol-6-yl]-piperidin-1-ylmethanone has a molecular weight of 433.62 g/mol, XLogP of 2.81, 8 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[[[1-(2-methoxyethyl)piperidin-4-yl]methyl-methylamino]methyl]imidazo[2,1-b][1,3]thiazol-6-yl]-piperidin-1-ylmethanone is sourced from PubChem (CID 42290230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).