N-benzyl-N-cyclopropyl-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide

C17H17N3OS — CID 38252253

IUPACN-benzyl-N-cyclopropyl-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide
SMILESO=C(Cc1cn2ccsc2n1)N(Cc1ccccc1)C1CC1
InChIInChI=1S/C17H17N3OS/c21-16(10-14-12-19-8-9-22-17(19)18-14)20(15-6-7-15)11-13-4-2-1-3-5-13/h1-5,8-9,12,15H,6-7,10-11H2
InChIKeyUDTPIVJWPYINJI-UHFFFAOYSA-N
MW311.41 g/mol
LogP3.13
Rot. Bonds5

About N-benzyl-N-cyclopropyl-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide

N-benzyl-N-cyclopropyl-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide (PubChem CID 38252253) has the molecular formula C17H17N3OS and a molecular weight of 311.41 g/mol. Its IUPAC name is N-benzyl-N-cyclopropyl-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide.

Molecular Properties

Compound NameN-benzyl-N-cyclopropyl-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide
PubChem CID38252253
Molecular FormulaC17H17N3OS
Molecular Weight311.41 g/mol
Exact Mass311.11
IUPAC NameN-benzyl-N-cyclopropyl-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide
SMILESO=C(Cc1cn2ccsc2n1)N(Cc1ccccc1)C1CC1
InChIInChI=1S/C17H17N3OS/c21-16(10-14-12-19-8-9-22-17(19)18-14)20(15-6-7-15)11-13-4-2-1-3-5-13/h1-5,8-9,12,15H,6-7,10-11H2
InChIKeyUDTPIVJWPYINJI-UHFFFAOYSA-N
XLogP3.13
TPSA37.61 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.41
LogP ≤ 53.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopropyl-2-imidazo[2,1-b][1,3]thiazol-6-yl-N-[(4-methoxyphenyl)methyl]acetamide
CID 31448979
N-(2-hydroxyethyl)-2-imidazo[2,1-b][1,3]thiazol-6-yl-N-(2-phenylethyl)acetamide
CID 111122119
N-(2-aminoethyl)-2-imidazo[2,1-b][1,3]thiazol-6-yl-N-(2-phenylethyl)acetamide;hydrochloride
CID 120884629
2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]acetamide
CID 31645281
1-(4-aminocyclohexyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanone
CID 116557487
3-cyclopropyl-1-imidazo[2,1-b][1,3]thiazol-6-ylbutan-2-one
CID 115792010
N-cyclopropyl-N-(thiophen-3-ylmethyl)imidazo[2,1-b][1,3]thiazole-6-carboxamide
CID 70704455
2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methyl-N-[(3-pyrazol-1-ylphenyl)methyl]acetamide
CID 70769748
N-ethyl-2-imidazo[2,1-b][1,3]thiazol-6-yl-N-[(4-oxo-3H-quinazolin-2-yl)methyl]acetamide
CID 135788199
N-[(2-hydroxycyclohexyl)methyl]-2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylacetamide
CID 110003774
2-imidazo[2,1-b][1,3]thiazol-6-yl-1-pyrrolidin-3-ylethanone
CID 116568454
N-[2-(dimethylamino)ethyl]-N-[(2-fluorophenyl)methyl]-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide
CID 16673658

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-cyclopropyl-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide?
The IUPAC name of N-benzyl-N-cyclopropyl-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide (CID 38252253) is N-benzyl-N-cyclopropyl-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide.
What is the SMILES notation for N-benzyl-N-cyclopropyl-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide?
The canonical SMILES for N-benzyl-N-cyclopropyl-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide is O=C(Cc1cn2ccsc2n1)N(Cc1ccccc1)C1CC1.
What is the InChIKey of N-benzyl-N-cyclopropyl-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide?
The InChIKey is UDTPIVJWPYINJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3OS/c21-16(10-14-12-19-8-9-22-17(19)18-14)20(15-6-7-15)11-13-4-2-1-3-5-13/h1-5,8-9,12,15H,6-7,10-11H2.
What are the key properties of N-benzyl-N-cyclopropyl-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide?
N-benzyl-N-cyclopropyl-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide has a molecular weight of 311.41 g/mol, XLogP of 3.13, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-cyclopropyl-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide is sourced from PubChem (CID 38252253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).