N-[(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-[2-(difluoromethoxy)phenyl]methanamine;hydrochloride

C14H13Cl2F2N3OS — CID 47028740

IUPACN-[(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-[2-(difluoromethoxy)phenyl]methanamine;hydrochloride
SMILESCl.FC(F)Oc1ccccc1CNCc1c(Cl)nc2sccn12
InChIInChI=1S/C14H12ClF2N3OS.ClH/c15-12-10(20-5-6-22-14(20)19-12)8-18-7-9-3-1-2-4-11(9)21-13(16)17;/h1-6,13,18H,7-8H2;1H
InChIKeyNQCLAJRRMNCEKP-UHFFFAOYSA-N
MW380.25 g/mol
LogP4.36
Rot. Bonds6

About N-[(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-[2-(difluoromethoxy)phenyl]methanamine;hydrochloride

N-[(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-[2-(difluoromethoxy)phenyl]methanamine;hydrochloride (PubChem CID 47028740) has the molecular formula C14H13Cl2F2N3OS and a molecular weight of 380.25 g/mol. Its IUPAC name is N-[(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-[2-(difluoromethoxy)phenyl]methanamine;hydrochloride.

Molecular Properties

Compound NameN-[(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-[2-(difluoromethoxy)phenyl]methanamine;hydrochloride
PubChem CID47028740
Molecular FormulaC14H13Cl2F2N3OS
Molecular Weight380.25 g/mol
Exact Mass379.01
IUPAC NameN-[(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-[2-(difluoromethoxy)phenyl]methanamine;hydrochloride
SMILESCl.FC(F)Oc1ccccc1CNCc1c(Cl)nc2sccn12
InChIInChI=1S/C14H12ClF2N3OS.ClH/c15-12-10(20-5-6-22-14(20)19-12)8-18-7-9-3-1-2-4-11(9)21-13(16)17;/h1-6,13,18H,7-8H2;1H
InChIKeyNQCLAJRRMNCEKP-UHFFFAOYSA-N
XLogP4.36
TPSA38.56 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.25
LogP ≤ 54.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-[2-(difluoromethoxy)phenyl]methanamine;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(6-methoxyimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-(2-methoxyphenyl)methanamine
CID 43758018
N-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-(2-methylphenyl)methanamine
CID 60913625
2-[(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)methylamino]-N-methylacetamide;hydrochloride
CID 115599070
1-(3,4-dichlorophenyl)-N-[[2-(difluoromethoxy)phenyl]methyl]methanamine
CID 29051450
N-[(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)methyl]pentan-1-amine
CID 115599064
1-(2-ethylphenyl)-N-[(6-methoxyimidazo[2,1-b][1,3]thiazol-5-yl)methyl]methanamine
CID 64681770
1-(4-bromo-2-chlorophenyl)-N-[[2-(difluoromethoxy)phenyl]methyl]methanamine
CID 115595287
2-[(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)methylamino]-1-(5-chlorothiophen-2-yl)ethanol
CID 111469551
1-[(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)methylamino]-2-thiophen-2-ylpropan-2-ol
CID 111440614
4-chloro-2-[[[2-(difluoromethoxy)phenyl]methylamino]methyl]phenol
CID 29292740
N-[(4,5-dibromofuran-2-yl)methyl]-1-[2-(difluoromethoxy)phenyl]methanamine
CID 62084106
N-[(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-2-methylcyclopropan-1-amine;hydrochloride
CID 115614598

Frequently Asked Questions

What is the IUPAC name of N-[(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-[2-(difluoromethoxy)phenyl]methanamine;hydrochloride?
The IUPAC name of N-[(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-[2-(difluoromethoxy)phenyl]methanamine;hydrochloride (CID 47028740) is N-[(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-[2-(difluoromethoxy)phenyl]methanamine;hydrochloride.
What is the SMILES notation for N-[(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-[2-(difluoromethoxy)phenyl]methanamine;hydrochloride?
The canonical SMILES for N-[(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-[2-(difluoromethoxy)phenyl]methanamine;hydrochloride is Cl.FC(F)Oc1ccccc1CNCc1c(Cl)nc2sccn12.
What is the InChIKey of N-[(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-[2-(difluoromethoxy)phenyl]methanamine;hydrochloride?
The InChIKey is NQCLAJRRMNCEKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12ClF2N3OS.ClH/c15-12-10(20-5-6-22-14(20)19-12)8-18-7-9-3-1-2-4-11(9)21-13(16)17;/h1-6,13,18H,7-8H2;1H.
What are the key properties of N-[(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-[2-(difluoromethoxy)phenyl]methanamine;hydrochloride?
N-[(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-[2-(difluoromethoxy)phenyl]methanamine;hydrochloride has a molecular weight of 380.25 g/mol, XLogP of 4.36, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-[2-(difluoromethoxy)phenyl]methanamine;hydrochloride is sourced from PubChem (CID 47028740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).