N-cyclopentyl-3-ethyl-6-(2-fluorophenyl)imidazo[2,1-b][1,3]thiazol-5-amine

C18H20FN3S — CID 70832391

IUPACN-cyclopentyl-3-ethyl-6-(2-fluorophenyl)imidazo[2,1-b][1,3]thiazol-5-amine
SMILESCCc1csc2nc(-c3ccccc3F)c(NC3CCCC3)n12
InChIInChI=1S/C18H20FN3S/c1-2-13-11-23-18-21-16(14-9-5-6-10-15(14)19)17(22(13)18)20-12-7-3-4-8-12/h5-6,9-12,20H,2-4,7-8H2,1H3
InChIKeyZJGLPZLMKFLILG-UHFFFAOYSA-N
MW329.44 g/mol
LogP5.12
Rot. Bonds4

About N-cyclopentyl-3-ethyl-6-(2-fluorophenyl)imidazo[2,1-b][1,3]thiazol-5-amine

N-cyclopentyl-3-ethyl-6-(2-fluorophenyl)imidazo[2,1-b][1,3]thiazol-5-amine (PubChem CID 70832391) has the molecular formula C18H20FN3S and a molecular weight of 329.44 g/mol. Its IUPAC name is N-cyclopentyl-3-ethyl-6-(2-fluorophenyl)imidazo[2,1-b][1,3]thiazol-5-amine.

Molecular Properties

Compound NameN-cyclopentyl-3-ethyl-6-(2-fluorophenyl)imidazo[2,1-b][1,3]thiazol-5-amine
PubChem CID70832391
Molecular FormulaC18H20FN3S
Molecular Weight329.44 g/mol
Exact Mass329.14
IUPAC NameN-cyclopentyl-3-ethyl-6-(2-fluorophenyl)imidazo[2,1-b][1,3]thiazol-5-amine
SMILESCCc1csc2nc(-c3ccccc3F)c(NC3CCCC3)n12
InChIInChI=1S/C18H20FN3S/c1-2-13-11-23-18-21-16(14-9-5-6-10-15(14)19)17(22(13)18)20-12-7-3-4-8-12/h5-6,9-12,20H,2-4,7-8H2,1H3
InChIKeyZJGLPZLMKFLILG-UHFFFAOYSA-N
XLogP5.12
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500329.44
LogP ≤ 55.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopentyl-6-(2,6-difluorophenyl)-3-ethylimidazo[2,1-b][1,3]thiazol-5-amine
CID 70832149
methyl 2-[5-(cyclopentylamino)-6-(2-fluorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetate
CID 59578831
2-[5-(cyclopentylamino)-6-(2,6-difluorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetaldehyde
CID 89011495
6-(2-chlorophenyl)-N-cyclopentyl-3-methylimidazo[2,1-b][1,3]thiazol-5-amine
CID 59579021
6-(2,4-difluorophenyl)-N-(2,6-dimethylphenyl)-3-ethylimidazo[2,1-b][1,3]thiazol-5-amine
CID 70832396
N-cyclohexyl-6-(2-fluoro-6-methoxyphenyl)-3-methylimidazo[2,1-b][1,3]thiazol-5-amine
CID 59579083
6-(2-bromophenyl)-N-cyclohexyl-3-phenylimidazo[2,1-b][1,3]thiazol-5-amine
CID 102310650
2-[5-(cyclohexylamino)-6-pyridin-2-ylimidazo[2,1-b][1,3]thiazol-3-yl]acetic acid
CID 22335543
N-cyclopentyl-6-(2,6-difluorophenyl)-2,3-dimethylimidazo[2,1-b][1,3]thiazol-5-amine
CID 59579223
6-(2-chloro-4-fluorophenyl)-N-(2,6-dimethylphenyl)-3-ethylimidazo[2,1-b][1,3]thiazol-5-amine
CID 70832437
N-cyclopentyl-6-(2,6-difluoro-4-methoxyphenyl)-3-methylimidazo[2,1-b][1,3]thiazol-5-amine
CID 59578872
3-cyclohexa-1,3-dien-1-yl-N-cyclopentyl-6-(2-fluoro-6-methoxyphenyl)imidazo[2,1-b][1,3]thiazol-5-amine
CID 71016404

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-3-ethyl-6-(2-fluorophenyl)imidazo[2,1-b][1,3]thiazol-5-amine?
The IUPAC name of N-cyclopentyl-3-ethyl-6-(2-fluorophenyl)imidazo[2,1-b][1,3]thiazol-5-amine (CID 70832391) is N-cyclopentyl-3-ethyl-6-(2-fluorophenyl)imidazo[2,1-b][1,3]thiazol-5-amine.
What is the SMILES notation for N-cyclopentyl-3-ethyl-6-(2-fluorophenyl)imidazo[2,1-b][1,3]thiazol-5-amine?
The canonical SMILES for N-cyclopentyl-3-ethyl-6-(2-fluorophenyl)imidazo[2,1-b][1,3]thiazol-5-amine is CCc1csc2nc(-c3ccccc3F)c(NC3CCCC3)n12.
What is the InChIKey of N-cyclopentyl-3-ethyl-6-(2-fluorophenyl)imidazo[2,1-b][1,3]thiazol-5-amine?
The InChIKey is ZJGLPZLMKFLILG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20FN3S/c1-2-13-11-23-18-21-16(14-9-5-6-10-15(14)19)17(22(13)18)20-12-7-3-4-8-12/h5-6,9-12,20H,2-4,7-8H2,1H3.
What are the key properties of N-cyclopentyl-3-ethyl-6-(2-fluorophenyl)imidazo[2,1-b][1,3]thiazol-5-amine?
N-cyclopentyl-3-ethyl-6-(2-fluorophenyl)imidazo[2,1-b][1,3]thiazol-5-amine has a molecular weight of 329.44 g/mol, XLogP of 5.12, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-3-ethyl-6-(2-fluorophenyl)imidazo[2,1-b][1,3]thiazol-5-amine is sourced from PubChem (CID 70832391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).