2-fluoro-2-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)butan-1-amine

C10H14FN3S — CID 112566154

IUPAC2-fluoro-2-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)butan-1-amine
SMILESCCC(F)(CN)Cc1cn2ccsc2n1
InChIInChI=1S/C10H14FN3S/c1-2-10(11,7-12)5-8-6-14-3-4-15-9(14)13-8/h3-4,6H,2,5,7,12H2,1H3
InChIKeyUYBWMEMVEPGQRS-UHFFFAOYSA-N
MW227.31 g/mol
LogP2.02
Rot. Bonds4

About 2-fluoro-2-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)butan-1-amine

2-fluoro-2-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)butan-1-amine (PubChem CID 112566154) has the molecular formula C10H14FN3S and a molecular weight of 227.31 g/mol. Its IUPAC name is 2-fluoro-2-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)butan-1-amine.

Molecular Properties

Compound Name2-fluoro-2-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)butan-1-amine
PubChem CID112566154
Molecular FormulaC10H14FN3S
Molecular Weight227.31 g/mol
Exact Mass227.09
IUPAC Name2-fluoro-2-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)butan-1-amine
SMILESCCC(F)(CN)Cc1cn2ccsc2n1
InChIInChI=1S/C10H14FN3S/c1-2-10(11,7-12)5-8-6-14-3-4-15-9(14)13-8/h3-4,6H,2,5,7,12H2,1H3
InChIKeyUYBWMEMVEPGQRS-UHFFFAOYSA-N
XLogP2.02
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-Fluoropropan-2-yl)-5,6-dimethylimidazo[2,1-b][1,3]thiazole
CID 146411693
2-Propan-2-yl-6-(trifluoromethyl)imidazo[2,1-b][1,3]thiazole
CID 178506601
6-Tert-butyl-3-methylimidazo[2,1-b][1,3]thiazole
CID 824450
2-[(6-Butylimidazo[2,1-b][1,3]thiazol-5-yl)amino]hexanenitrile
CID 122220242
6-cyclopropyl-N-(2,4,4-trimethylpentan-2-yl)imidazo[2,1-b][1,3]thiazol-5-amine
CID 162406364
5-(2-aminoethyl)-N-methyl-N-(2,2,2-trifluoroethyl)imidazo[2,1-b][1,3]thiazol-6-amine
CID 55236383
5-(2-aminoethyl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)imidazo[2,1-b][1,3]thiazol-6-amine
CID 63786829
5-(2-aminoethyl)-N-ethyl-N-(2,2,2-trifluoroethyl)imidazo[2,1-b][1,3]thiazol-6-amine
CID 63787511
5-(2-aminoethyl)-N-propyl-N-(2,2,2-trifluoroethyl)imidazo[2,1-b][1,3]thiazol-6-amine
CID 63787515
5-(2-aminopropyl)-N-propyl-N-(2,2,2-trifluoroethyl)imidazo[2,1-b][1,3]thiazol-6-amine
CID 63794372
5-(2-aminobutyl)-N-methyl-N-(2,2,2-trifluoroethyl)imidazo[2,1-b][1,3]thiazol-6-amine
CID 63794666
5-(2-aminopropyl)-N-methyl-N-(2,2,2-trifluoroethyl)imidazo[2,1-b][1,3]thiazol-6-amine
CID 63795015

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-2-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)butan-1-amine?
The IUPAC name of 2-fluoro-2-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)butan-1-amine (CID 112566154) is 2-fluoro-2-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)butan-1-amine.
What is the SMILES notation for 2-fluoro-2-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)butan-1-amine?
The canonical SMILES for 2-fluoro-2-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)butan-1-amine is CCC(F)(CN)Cc1cn2ccsc2n1.
What is the InChIKey of 2-fluoro-2-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)butan-1-amine?
The InChIKey is UYBWMEMVEPGQRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14FN3S/c1-2-10(11,7-12)5-8-6-14-3-4-15-9(14)13-8/h3-4,6H,2,5,7,12H2,1H3.
What are the key properties of 2-fluoro-2-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)butan-1-amine?
2-fluoro-2-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)butan-1-amine has a molecular weight of 227.31 g/mol, XLogP of 2.02, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-2-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)butan-1-amine is sourced from PubChem (CID 112566154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).