N-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)-3-pyridin-3-ylpropanamide

C15H16N4OS — CID 90652526

IUPACN-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)-3-pyridin-3-ylpropanamide
SMILESO=C(CCc1cccnc1)NCCc1cn2ccsc2n1
InChIInChI=1S/C15H16N4OS/c20-14(4-3-12-2-1-6-16-10-12)17-7-5-13-11-19-8-9-21-15(19)18-13/h1-2,6,8-11H,3-5,7H2,(H,17,20)
InChIKeyLDBVPWYLZIEZGA-UHFFFAOYSA-N
MW300.39 g/mol
LogP2.08
Rot. Bonds6

About N-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)-3-pyridin-3-ylpropanamide

N-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)-3-pyridin-3-ylpropanamide (PubChem CID 90652526) has the molecular formula C15H16N4OS and a molecular weight of 300.39 g/mol. Its IUPAC name is N-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)-3-pyridin-3-ylpropanamide.

Molecular Properties

Compound NameN-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)-3-pyridin-3-ylpropanamide
PubChem CID90652526
Molecular FormulaC15H16N4OS
Molecular Weight300.39 g/mol
Exact Mass300.10
IUPAC NameN-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)-3-pyridin-3-ylpropanamide
SMILESO=C(CCc1cccnc1)NCCc1cn2ccsc2n1
InChIInChI=1S/C15H16N4OS/c20-14(4-3-12-2-1-6-16-10-12)17-7-5-13-11-19-8-9-21-15(19)18-13/h1-2,6,8-11H,3-5,7H2,(H,17,20)
InChIKeyLDBVPWYLZIEZGA-UHFFFAOYSA-N
XLogP2.08
TPSA59.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.39
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-imidazo[2,1-b][1,3]thiazol-6-yl-4-pyridin-3-ylbutan-2-one
CID 105123036
2-imidazo[2,1-b][1,3]thiazol-6-yl-N-(pyridin-3-ylmethyl)acetamide
CID 35511835
N-[2-(2-imidazo[2,1-b][1,3]thiazol-6-ylethylamino)-2-oxoethyl]benzamide
CID 110661562
N-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)-4-pyridin-3-ylpyrimidin-2-amine
CID 72839271
N-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)thiophene-2-carboxamide
CID 5310147
4-[4-(2-imidazo[2,1-b][1,3]thiazol-6-ylethylamino)piperidin-1-yl]-N-(pyridin-3-ylmethyl)benzamide
CID 42276196
3-(4,6-dimethyl-2-oxo-1H-pyrimidin-5-yl)-N-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)propanamide
CID 118777156
1-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)-3-propylurea
CID 110661644
methyl 4-oxo-4-(2-pyridin-3-ylethylamino)butanoate
CID 115174685
N-(2-phenylethyl)-4-pyridin-3-ylbutanamide
CID 110410890
(2S)-2-hydroxy-4-(3-pyridin-3-ylpropanoylamino)butanoic acid
CID 107834523
2-imidazo[2,1-b][1,3]thiazol-6-yl-N-(2-phenoxyethyl)acetamide
CID 32933501

Frequently Asked Questions

What is the IUPAC name of N-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)-3-pyridin-3-ylpropanamide?
The IUPAC name of N-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)-3-pyridin-3-ylpropanamide (CID 90652526) is N-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)-3-pyridin-3-ylpropanamide.
What is the SMILES notation for N-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)-3-pyridin-3-ylpropanamide?
The canonical SMILES for N-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)-3-pyridin-3-ylpropanamide is O=C(CCc1cccnc1)NCCc1cn2ccsc2n1.
What is the InChIKey of N-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)-3-pyridin-3-ylpropanamide?
The InChIKey is LDBVPWYLZIEZGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4OS/c20-14(4-3-12-2-1-6-16-10-12)17-7-5-13-11-19-8-9-21-15(19)18-13/h1-2,6,8-11H,3-5,7H2,(H,17,20).
What are the key properties of N-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)-3-pyridin-3-ylpropanamide?
N-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)-3-pyridin-3-ylpropanamide has a molecular weight of 300.39 g/mol, XLogP of 2.08, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)-3-pyridin-3-ylpropanamide is sourced from PubChem (CID 90652526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).