1-(2,5-difluorophenyl)-N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]methanamine

C15H15F2N3S — CID 63379683

IUPAC1-(2,5-difluorophenyl)-N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]methanamine
SMILESCc1cn2c(CNCc3cc(F)ccc3F)c(C)nc2s1
InChIInChI=1S/C15H15F2N3S/c1-9-8-20-14(10(2)19-15(20)21-9)7-18-6-11-5-12(16)3-4-13(11)17/h3-5,8,18H,6-7H2,1-2H3
InChIKeyRESRZGMYKGOAEW-UHFFFAOYSA-N
MW307.37 g/mol
LogP3.58
Rot. Bonds4

About 1-(2,5-difluorophenyl)-N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]methanamine

1-(2,5-difluorophenyl)-N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]methanamine (PubChem CID 63379683) has the molecular formula C15H15F2N3S and a molecular weight of 307.37 g/mol. Its IUPAC name is 1-(2,5-difluorophenyl)-N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]methanamine.

Molecular Properties

Compound Name1-(2,5-difluorophenyl)-N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]methanamine
PubChem CID63379683
Molecular FormulaC15H15F2N3S
Molecular Weight307.37 g/mol
Exact Mass307.10
IUPAC Name1-(2,5-difluorophenyl)-N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]methanamine
SMILESCc1cn2c(CNCc3cc(F)ccc3F)c(C)nc2s1
InChIInChI=1S/C15H15F2N3S/c1-9-8-20-14(10(2)19-15(20)21-9)7-18-6-11-5-12(16)3-4-13(11)17/h3-5,8,18H,6-7H2,1-2H3
InChIKeyRESRZGMYKGOAEW-UHFFFAOYSA-N
XLogP3.58
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.37
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-(3-methylphenyl)methanamine
CID 43625818
2-(4-chlorophenyl)-N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]ethanamine
CID 43625798
N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-2,5-dimethylpyrrol-1-amine
CID 79101097
N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-pyridazin-3-ylmethanamine
CID 106834011
N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-(3,5-dimethyl-1,2-oxazol-4-yl)methanamine
CID 78988134
2-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methylamino]-1-phenylethanol
CID 43625895
methyl 2-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methylamino]acetate
CID 43625703
N-[2-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methylamino]ethyl]-2-methylpropanamide
CID 43625807
1-(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)-N-[(4-methyl-1,2,4-triazol-3-yl)methyl]methanamine
CID 54895948
2,4,6-trichloro-N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]aniline
CID 43625869
6-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methylamino]hexan-1-ol
CID 103924077
4-[2-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methylamino]ethyl]phenol
CID 61238024

Frequently Asked Questions

What is the IUPAC name of 1-(2,5-difluorophenyl)-N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]methanamine?
The IUPAC name of 1-(2,5-difluorophenyl)-N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]methanamine (CID 63379683) is 1-(2,5-difluorophenyl)-N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]methanamine.
What is the SMILES notation for 1-(2,5-difluorophenyl)-N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]methanamine?
The canonical SMILES for 1-(2,5-difluorophenyl)-N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]methanamine is Cc1cn2c(CNCc3cc(F)ccc3F)c(C)nc2s1.
What is the InChIKey of 1-(2,5-difluorophenyl)-N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]methanamine?
The InChIKey is RESRZGMYKGOAEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15F2N3S/c1-9-8-20-14(10(2)19-15(20)21-9)7-18-6-11-5-12(16)3-4-13(11)17/h3-5,8,18H,6-7H2,1-2H3.
What are the key properties of 1-(2,5-difluorophenyl)-N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]methanamine?
1-(2,5-difluorophenyl)-N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]methanamine has a molecular weight of 307.37 g/mol, XLogP of 3.58, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,5-difluorophenyl)-N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]methanamine is sourced from PubChem (CID 63379683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).