N-[[6-(3-fluorophenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]cyclopropanamine

C15H14FN3OS — CID 43476727

IUPACN-[[6-(3-fluorophenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]cyclopropanamine
SMILESFc1cccc(Oc2nc3sccn3c2CNC2CC2)c1
InChIInChI=1S/C15H14FN3OS/c16-10-2-1-3-12(8-10)20-14-13(9-17-11-4-5-11)19-6-7-21-15(19)18-14/h1-3,6-8,11,17H,4-5,9H2
InChIKeyXNHYATSSRBZGGL-UHFFFAOYSA-N
MW303.36 g/mol
LogP3.58
Rot. Bonds5

About N-[[6-(3-fluorophenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]cyclopropanamine

N-[[6-(3-fluorophenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]cyclopropanamine (PubChem CID 43476727) has the molecular formula C15H14FN3OS and a molecular weight of 303.36 g/mol. Its IUPAC name is N-[[6-(3-fluorophenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[6-(3-fluorophenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]cyclopropanamine
PubChem CID43476727
Molecular FormulaC15H14FN3OS
Molecular Weight303.36 g/mol
Exact Mass303.08
IUPAC NameN-[[6-(3-fluorophenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]cyclopropanamine
SMILESFc1cccc(Oc2nc3sccn3c2CNC2CC2)c1
InChIInChI=1S/C15H14FN3OS/c16-10-2-1-3-12(8-10)20-14-13(9-17-11-4-5-11)19-6-7-21-15(19)18-14/h1-3,6-8,11,17H,4-5,9H2
InChIKeyXNHYATSSRBZGGL-UHFFFAOYSA-N
XLogP3.58
TPSA38.56 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.36
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-(chloromethyl)-6-(3-fluorophenoxy)imidazo[2,1-b][1,3]thiazole
CID 43476148
N-[(6-methoxyimidazo[2,1-b][1,3]thiazol-5-yl)methyl]cyclooctanamine
CID 43760152
[6-(3-methylphenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]methanol
CID 43476129
[6-(3,5-difluorophenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine
CID 62785052
1-[6-(3-bromo-4-fluorophenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]-N-methylmethanamine
CID 83234476
N-[[3-fluoro-2-(3-fluorophenoxy)-4-pyridinyl]methyl]cyclopropanamine
CID 105391271
N-[[6-(3-fluoro-4-methylphenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]ethanamine
CID 107169863
2-[6-(3,5-difluorophenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]ethanamine
CID 63803338
1-[6-(2,3-difluorophenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]-N-methylmethanamine
CID 63037655
N-[(6-methoxyimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-3,5-dimethylcyclohexan-1-amine
CID 64734020
N-[[2-(3-fluorophenoxy)phenyl]methyl]cyclopropanamine
CID 43283337
3-[(6-methoxyimidazo[2,1-b][1,3]thiazol-5-yl)methylamino]cyclohexan-1-ol
CID 43792297

Frequently Asked Questions

What is the IUPAC name of N-[[6-(3-fluorophenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]cyclopropanamine?
The IUPAC name of N-[[6-(3-fluorophenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]cyclopropanamine (CID 43476727) is N-[[6-(3-fluorophenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[6-(3-fluorophenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]cyclopropanamine?
The canonical SMILES for N-[[6-(3-fluorophenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]cyclopropanamine is Fc1cccc(Oc2nc3sccn3c2CNC2CC2)c1.
What is the InChIKey of N-[[6-(3-fluorophenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]cyclopropanamine?
The InChIKey is XNHYATSSRBZGGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14FN3OS/c16-10-2-1-3-12(8-10)20-14-13(9-17-11-4-5-11)19-6-7-21-15(19)18-14/h1-3,6-8,11,17H,4-5,9H2.
What are the key properties of N-[[6-(3-fluorophenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]cyclopropanamine?
N-[[6-(3-fluorophenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]cyclopropanamine has a molecular weight of 303.36 g/mol, XLogP of 3.58, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[6-(3-fluorophenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]cyclopropanamine is sourced from PubChem (CID 43476727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).