N-[1-(dimethylamino)-2-methylpropan-2-yl]-6-[3-(trifluoromethyl)phenyl]imidazo[2,1-b][1,3]thiazole-3-carboxamide

C19H21F3N4OS — CID 56748657

IUPACN-[1-(dimethylamino)-2-methylpropan-2-yl]-6-[3-(trifluoromethyl)phenyl]imidazo[2,1-b][1,3]thiazole-3-carboxamide
SMILESCN(C)CC(C)(C)NC(=O)c1csc2nc(-c3cccc(C(F)(F)F)c3)cn12
InChIInChI=1S/C19H21F3N4OS/c1-18(2,11-25(3)4)24-16(27)15-10-28-17-23-14(9-26(15)17)12-6-5-7-13(8-12)19(20,21)22/h5-10H,11H2,1-4H3,(H,24,27)
InChIKeyUGHHGKFIKYDMDC-UHFFFAOYSA-N
MW410.47 g/mol
LogP4.15
Rot. Bonds5

About N-[1-(dimethylamino)-2-methylpropan-2-yl]-6-[3-(trifluoromethyl)phenyl]imidazo[2,1-b][1,3]thiazole-3-carboxamide

N-[1-(dimethylamino)-2-methylpropan-2-yl]-6-[3-(trifluoromethyl)phenyl]imidazo[2,1-b][1,3]thiazole-3-carboxamide (PubChem CID 56748657) has the molecular formula C19H21F3N4OS and a molecular weight of 410.47 g/mol. Its IUPAC name is N-[1-(dimethylamino)-2-methylpropan-2-yl]-6-[3-(trifluoromethyl)phenyl]imidazo[2,1-b][1,3]thiazole-3-carboxamide.

Molecular Properties

Compound NameN-[1-(dimethylamino)-2-methylpropan-2-yl]-6-[3-(trifluoromethyl)phenyl]imidazo[2,1-b][1,3]thiazole-3-carboxamide
PubChem CID56748657
Molecular FormulaC19H21F3N4OS
Molecular Weight410.47 g/mol
Exact Mass410.14
IUPAC NameN-[1-(dimethylamino)-2-methylpropan-2-yl]-6-[3-(trifluoromethyl)phenyl]imidazo[2,1-b][1,3]thiazole-3-carboxamide
SMILESCN(C)CC(C)(C)NC(=O)c1csc2nc(-c3cccc(C(F)(F)F)c3)cn12
InChIInChI=1S/C19H21F3N4OS/c1-18(2,11-25(3)4)24-16(27)15-10-28-17-23-14(9-26(15)17)12-6-5-7-13(8-12)19(20,21)22/h5-10H,11H2,1-4H3,(H,24,27)
InChIKeyUGHHGKFIKYDMDC-UHFFFAOYSA-N
XLogP4.15
TPSA49.64 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.47
LogP ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)acetamide
CID 685797
4-Thiazolecarboxamide, N-[5-[[[[(1S)-1-[3,5-bis(trifluoromethyl)phenyl]ethyl]amino]thioxomethyl]amino]-2-pyridinyl]-
CID 3010086
N-(4-(diethylamino)phenyl)-3-methyl-6-phenylimidazo[2,1-b]thiazole-2-carboxamide
CID 16029593
3-(difluoromethylsulfanyl)-N-[2-[3-(piperazin-1-ylmethyl)imidazo[2,1-b][1,3]thiazol-6-yl]phenyl]benzamide
CID 25233238
6-(4-fluorophenyl)-N-methyl-2-[3-[(1-pyridin-2-ylcyclopropyl)carbamoyl]phenyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide
CID 71572034
6-(4-fluorophenyl)-N-methyl-2-[3-(2-phenylpropan-2-ylcarbamoyl)phenyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide
CID 71572035
2-[4-(4-Fluoro-3-methylphenyl)-2-(4-fluorophenyl)imidazol-1-yl]-1-(2-methyl-4,6-dihydropyrrolo[3,4-d][1,3]thiazol-5-yl)ethanone
CID 71656844
N-[4-[2-[3,5-bis(trifluoromethyl)phenyl]-1H-imidazol-5-yl]phenyl]-1,3-thiazole-4-carboxamide
CID 74223854
N-[2-oxo-1-[2-[1-[3-(trifluoromethyl)phenyl]ethyl]-1H-imidazol-5-yl]pyridin-4-yl]-1,3-thiazole-4-carboxamide
CID 74223859
N-[2-(3-Chlorophenyl)ethyl]-3-(4-Methylphenyl)imidazo[2,1-B][1,3]thiazole-5-Carboxamide
CID 118716433
N-(3-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)butanamide
CID 752439
N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-3-methylbutanamide
CID 852132

Frequently Asked Questions

What is the IUPAC name of N-[1-(dimethylamino)-2-methylpropan-2-yl]-6-[3-(trifluoromethyl)phenyl]imidazo[2,1-b][1,3]thiazole-3-carboxamide?
The IUPAC name of N-[1-(dimethylamino)-2-methylpropan-2-yl]-6-[3-(trifluoromethyl)phenyl]imidazo[2,1-b][1,3]thiazole-3-carboxamide (CID 56748657) is N-[1-(dimethylamino)-2-methylpropan-2-yl]-6-[3-(trifluoromethyl)phenyl]imidazo[2,1-b][1,3]thiazole-3-carboxamide.
What is the SMILES notation for N-[1-(dimethylamino)-2-methylpropan-2-yl]-6-[3-(trifluoromethyl)phenyl]imidazo[2,1-b][1,3]thiazole-3-carboxamide?
The canonical SMILES for N-[1-(dimethylamino)-2-methylpropan-2-yl]-6-[3-(trifluoromethyl)phenyl]imidazo[2,1-b][1,3]thiazole-3-carboxamide is CN(C)CC(C)(C)NC(=O)c1csc2nc(-c3cccc(C(F)(F)F)c3)cn12.
What is the InChIKey of N-[1-(dimethylamino)-2-methylpropan-2-yl]-6-[3-(trifluoromethyl)phenyl]imidazo[2,1-b][1,3]thiazole-3-carboxamide?
The InChIKey is UGHHGKFIKYDMDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21F3N4OS/c1-18(2,11-25(3)4)24-16(27)15-10-28-17-23-14(9-26(15)17)12-6-5-7-13(8-12)19(20,21)22/h5-10H,11H2,1-4H3,(H,24,27).
What are the key properties of N-[1-(dimethylamino)-2-methylpropan-2-yl]-6-[3-(trifluoromethyl)phenyl]imidazo[2,1-b][1,3]thiazole-3-carboxamide?
N-[1-(dimethylamino)-2-methylpropan-2-yl]-6-[3-(trifluoromethyl)phenyl]imidazo[2,1-b][1,3]thiazole-3-carboxamide has a molecular weight of 410.47 g/mol, XLogP of 4.15, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(dimethylamino)-2-methylpropan-2-yl]-6-[3-(trifluoromethyl)phenyl]imidazo[2,1-b][1,3]thiazole-3-carboxamide is sourced from PubChem (CID 56748657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).