N-[[2-(cyclopropylmethoxy)phenyl]methyl]-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide

C18H19N3O2S — CID 71930246

IUPACN-[[2-(cyclopropylmethoxy)phenyl]methyl]-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide
SMILESO=C(Cc1cn2ccsc2n1)NCc1ccccc1OCC1CC1
InChIInChI=1S/C18H19N3O2S/c22-17(9-15-11-21-7-8-24-18(21)20-15)19-10-14-3-1-2-4-16(14)23-12-13-5-6-13/h1-4,7-8,11,13H,5-6,9-10,12H2,(H,19,22)
InChIKeyBEKOPNKPYYAPFM-UHFFFAOYSA-N
MW341.44 g/mol
LogP3.04
Rot. Bonds7

About N-[[2-(cyclopropylmethoxy)phenyl]methyl]-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide

N-[[2-(cyclopropylmethoxy)phenyl]methyl]-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide (PubChem CID 71930246) has the molecular formula C18H19N3O2S and a molecular weight of 341.44 g/mol. Its IUPAC name is N-[[2-(cyclopropylmethoxy)phenyl]methyl]-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide.

Molecular Properties

Compound NameN-[[2-(cyclopropylmethoxy)phenyl]methyl]-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide
PubChem CID71930246
Molecular FormulaC18H19N3O2S
Molecular Weight341.44 g/mol
Exact Mass341.12
IUPAC NameN-[[2-(cyclopropylmethoxy)phenyl]methyl]-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide
SMILESO=C(Cc1cn2ccsc2n1)NCc1ccccc1OCC1CC1
InChIInChI=1S/C18H19N3O2S/c22-17(9-15-11-21-7-8-24-18(21)20-15)19-10-14-3-1-2-4-16(14)23-12-13-5-6-13/h1-4,7-8,11,13H,5-6,9-10,12H2,(H,19,22)
InChIKeyBEKOPNKPYYAPFM-UHFFFAOYSA-N
XLogP3.04
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.44
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-imidazo[2,1-b][1,3]thiazol-6-yl-N-[(2-phenylmethoxyphenyl)methyl]acetamide
CID 55806275
2-imidazo[2,1-b][1,3]thiazol-6-yl-N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]acetamide
CID 17439083
2-imidazo[2,1-b][1,3]thiazol-6-yl-N-[[2-(propoxymethyl)phenyl]methyl]acetamide
CID 87006464
2-amino-N-[[2-(cyclopropylmethoxy)phenyl]methyl]acetamide
CID 119325506
2-imidazo[2,1-b][1,3]thiazol-6-yl-N-(2-phenoxyethyl)acetamide
CID 32933501
N-[(2,3-difluoro-4-methoxyphenyl)methyl]-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide
CID 74238451
N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-2-(2-nitrophenyl)acetamide
CID 134027757
2-imidazo[2,1-b][1,3]thiazol-6-yl-N-(pyridin-3-ylmethyl)acetamide
CID 35511835
2-imidazo[2,1-b][1,3]thiazol-6-yl-N-phenylacetamide
CID 4623847
N-[2-(3-ethoxycyclobutyl)ethyl]-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide
CID 126773652
N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-2-phenylsulfanylacetamide
CID 52569566
methyl 3-[(2-imidazo[2,1-b][1,3]thiazol-6-ylacetyl)amino]propanoate
CID 60690600

Frequently Asked Questions

What is the IUPAC name of N-[[2-(cyclopropylmethoxy)phenyl]methyl]-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide?
The IUPAC name of N-[[2-(cyclopropylmethoxy)phenyl]methyl]-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide (CID 71930246) is N-[[2-(cyclopropylmethoxy)phenyl]methyl]-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide.
What is the SMILES notation for N-[[2-(cyclopropylmethoxy)phenyl]methyl]-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide?
The canonical SMILES for N-[[2-(cyclopropylmethoxy)phenyl]methyl]-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide is O=C(Cc1cn2ccsc2n1)NCc1ccccc1OCC1CC1.
What is the InChIKey of N-[[2-(cyclopropylmethoxy)phenyl]methyl]-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide?
The InChIKey is BEKOPNKPYYAPFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O2S/c22-17(9-15-11-21-7-8-24-18(21)20-15)19-10-14-3-1-2-4-16(14)23-12-13-5-6-13/h1-4,7-8,11,13H,5-6,9-10,12H2,(H,19,22).
What are the key properties of N-[[2-(cyclopropylmethoxy)phenyl]methyl]-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide?
N-[[2-(cyclopropylmethoxy)phenyl]methyl]-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide has a molecular weight of 341.44 g/mol, XLogP of 3.04, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(cyclopropylmethoxy)phenyl]methyl]-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide is sourced from PubChem (CID 71930246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).