3-(4-methoxyphenyl)-N-[2-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)ethyl]propanamide

C18H21N3O2S — CID 5310025

IUPAC3-(4-methoxyphenyl)-N-[2-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)ethyl]propanamide
SMILESCOc1ccc(CCC(=O)NCCc2cn3c(C)csc3n2)cc1
InChIInChI=1S/C18H21N3O2S/c1-13-12-24-18-20-15(11-21(13)18)9-10-19-17(22)8-5-14-3-6-16(23-2)7-4-14/h3-4,6-7,11-12H,5,8-10H2,1-2H3,(H,19,22)
InChIKeyMNLVSRGNXRZDSL-UHFFFAOYSA-N
MW343.45 g/mol
LogP3.00
Rot. Bonds7

About 3-(4-methoxyphenyl)-N-[2-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)ethyl]propanamide

3-(4-methoxyphenyl)-N-[2-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)ethyl]propanamide (PubChem CID 5310025) has the molecular formula C18H21N3O2S and a molecular weight of 343.45 g/mol. Its IUPAC name is 3-(4-methoxyphenyl)-N-[2-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)ethyl]propanamide.

Molecular Properties

Compound Name3-(4-methoxyphenyl)-N-[2-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)ethyl]propanamide
PubChem CID5310025
Molecular FormulaC18H21N3O2S
Molecular Weight343.45 g/mol
Exact Mass343.14
IUPAC Name3-(4-methoxyphenyl)-N-[2-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)ethyl]propanamide
SMILESCOc1ccc(CCC(=O)NCCc2cn3c(C)csc3n2)cc1
InChIInChI=1S/C18H21N3O2S/c1-13-12-24-18-20-15(11-21(13)18)9-10-19-17(22)8-5-14-3-6-16(23-2)7-4-14/h3-4,6-7,11-12H,5,8-10H2,1-2H3,(H,19,22)
InChIKeyMNLVSRGNXRZDSL-UHFFFAOYSA-N
XLogP3.00
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.45
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N,N-diethyl-6-(4-methoxyphenyl)-3-methylimidazo[2,1-b][1,3]thiazole-2-carboxamide
CID 3238337
3,4-dimethoxy-N-[(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)methyl]benzamide
CID 3238659
6-(4-methoxyphenyl)-3-methyl-N-(2-morpholin-4-ylethyl)imidazo[2,1-b][1,3]thiazole-2-carboxamide
CID 3241138
N-isopropyl-6-(4-methoxyphenyl)-3-methylimidazo[2,1-b][1,3]thiazole-2-carboxamide
CID 3241505
6-(4-methoxyphenyl)-3-methyl-N-(6-methylpyridin-2-yl)imidazo[2,1-b][1,3]thiazole-2-carboxamide
CID 3242860
6-(4-methoxyphenyl)-N,3-dimethyl-2-imidazo[2,1-b]thiazolecarboxamide
CID 5158448
N-tert-butyl-6-(4-methoxyphenyl)-3-methylimidazo[2,1-b][1,3]thiazole-2-carboxamide
CID 5158449
6-(4-methoxyphenyl)-3-methyl-N-pyridin-4-ylimidazo[2,1-b][1,3]thiazole-2-carboxamide
CID 5310246
N-(4-methoxybenzyl)-2-(6-(p-tolyl)imidazo[2,1-b]thiazol-3-yl)acetamide
CID 16029114
N-(3,5-dimethylphenyl)-6-(4-methoxyphenyl)-3-methylimidazo[2,1-b][1,3]thiazole-2-carboxamide
CID 16029654
2-bromo-N-[3-[3-(4-methoxyphenyl)imidazo[2,1-b][1,3]thiazol-6-yl]phenyl]prop-2-enamide
CID 122187540
3-fluoro-4-methoxy-N-[2-[3-(piperazin-1-ylmethyl)imidazo[2,1-b][1,3]thiazol-6-yl]phenyl]benzamide
CID 25232165

Frequently Asked Questions

What is the IUPAC name of 3-(4-methoxyphenyl)-N-[2-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)ethyl]propanamide?
The IUPAC name of 3-(4-methoxyphenyl)-N-[2-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)ethyl]propanamide (CID 5310025) is 3-(4-methoxyphenyl)-N-[2-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)ethyl]propanamide.
What is the SMILES notation for 3-(4-methoxyphenyl)-N-[2-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)ethyl]propanamide?
The canonical SMILES for 3-(4-methoxyphenyl)-N-[2-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)ethyl]propanamide is COc1ccc(CCC(=O)NCCc2cn3c(C)csc3n2)cc1.
What is the InChIKey of 3-(4-methoxyphenyl)-N-[2-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)ethyl]propanamide?
The InChIKey is MNLVSRGNXRZDSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O2S/c1-13-12-24-18-20-15(11-21(13)18)9-10-19-17(22)8-5-14-3-6-16(23-2)7-4-14/h3-4,6-7,11-12H,5,8-10H2,1-2H3,(H,19,22).
What are the key properties of 3-(4-methoxyphenyl)-N-[2-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)ethyl]propanamide?
3-(4-methoxyphenyl)-N-[2-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)ethyl]propanamide has a molecular weight of 343.45 g/mol, XLogP of 3.00, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methoxyphenyl)-N-[2-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)ethyl]propanamide is sourced from PubChem (CID 5310025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).