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

C16H19N3S — CID 43625818

IUPACN-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-(3-methylphenyl)methanamine
SMILESCc1cccc(CNCc2c(C)nc3sc(C)cn23)c1
InChIInChI=1S/C16H19N3S/c1-11-5-4-6-14(7-11)8-17-9-15-13(3)18-16-19(15)10-12(2)20-16/h4-7,10,17H,8-9H2,1-3H3
InChIKeyMMIAGGSKLANGNG-UHFFFAOYSA-N
MW285.42 g/mol
LogP3.61
Rot. Bonds4

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

N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-(3-methylphenyl)methanamine (PubChem CID 43625818) has the molecular formula C16H19N3S and a molecular weight of 285.42 g/mol. Its IUPAC name is N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-(3-methylphenyl)methanamine.

Molecular Properties

Compound NameN-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-(3-methylphenyl)methanamine
PubChem CID43625818
Molecular FormulaC16H19N3S
Molecular Weight285.42 g/mol
Exact Mass285.13
IUPAC NameN-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-(3-methylphenyl)methanamine
SMILESCc1cccc(CNCc2c(C)nc3sc(C)cn23)c1
InChIInChI=1S/C16H19N3S/c1-11-5-4-6-14(7-11)8-17-9-15-13(3)18-16-19(15)10-12(2)20-16/h4-7,10,17H,8-9H2,1-3H3
InChIKeyMMIAGGSKLANGNG-UHFFFAOYSA-N
XLogP3.61
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.42
LogP ≤ 53.61
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]-2,5-dimethylpyrrol-1-amine
CID 79101097
1-(2,5-difluorophenyl)-N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]methanamine
CID 63379683
2,6-dichloro-N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]aniline
CID 65467972
2-(4-chlorophenyl)-N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]ethanamine
CID 43625798
4-[2-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methylamino]ethyl]phenol
CID 61238024
N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-2-methoxyethanamine
CID 43625696
2-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methylamino]-1-phenylethanol
CID 43625895
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
6-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methylamino]hexan-1-ol
CID 103924077
N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-3-ethoxyaniline
CID 60936482
N-[2-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methylamino]ethyl]methanesulfonamide
CID 43625851
1-(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)-N-[(1-propylcyclopropyl)methyl]methanamine
CID 103761998

Frequently Asked Questions

What is the IUPAC name of N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-(3-methylphenyl)methanamine?
The IUPAC name of N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-(3-methylphenyl)methanamine (CID 43625818) is N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-(3-methylphenyl)methanamine.
What is the SMILES notation for N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-(3-methylphenyl)methanamine?
The canonical SMILES for N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-(3-methylphenyl)methanamine is Cc1cccc(CNCc2c(C)nc3sc(C)cn23)c1.
What is the InChIKey of N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-(3-methylphenyl)methanamine?
The InChIKey is MMIAGGSKLANGNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3S/c1-11-5-4-6-14(7-11)8-17-9-15-13(3)18-16-19(15)10-12(2)20-16/h4-7,10,17H,8-9H2,1-3H3.
What are the key properties of N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-(3-methylphenyl)methanamine?
N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-(3-methylphenyl)methanamine has a molecular weight of 285.42 g/mol, XLogP of 3.61, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-(3-methylphenyl)methanamine is sourced from PubChem (CID 43625818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).