N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-(3,5-dimethyl-1,2-oxazol-4-yl)methanamine

C14H18N4OS — CID 78988134

IUPACN-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-(3,5-dimethyl-1,2-oxazol-4-yl)methanamine
SMILESCc1cn2c(CNCc3c(C)noc3C)c(C)nc2s1
InChIInChI=1S/C14H18N4OS/c1-8-7-18-13(10(3)16-14(18)20-8)6-15-5-12-9(2)17-19-11(12)4/h7,15H,5-6H2,1-4H3
InChIKeyMEQRLXGXLRAVJO-UHFFFAOYSA-N
MW290.39 g/mol
LogP2.91
Rot. Bonds4

About N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-(3,5-dimethyl-1,2-oxazol-4-yl)methanamine

N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-(3,5-dimethyl-1,2-oxazol-4-yl)methanamine (PubChem CID 78988134) has the molecular formula C14H18N4OS and a molecular weight of 290.39 g/mol. Its IUPAC name is N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-(3,5-dimethyl-1,2-oxazol-4-yl)methanamine.

Molecular Properties

Compound NameN-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-(3,5-dimethyl-1,2-oxazol-4-yl)methanamine
PubChem CID78988134
Molecular FormulaC14H18N4OS
Molecular Weight290.39 g/mol
Exact Mass290.12
IUPAC NameN-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-(3,5-dimethyl-1,2-oxazol-4-yl)methanamine
SMILESCc1cn2c(CNCc3c(C)noc3C)c(C)nc2s1
InChIInChI=1S/C14H18N4OS/c1-8-7-18-13(10(3)16-14(18)20-8)6-15-5-12-9(2)17-19-11(12)4/h7,15H,5-6H2,1-4H3
InChIKeyMEQRLXGXLRAVJO-UHFFFAOYSA-N
XLogP2.91
TPSA55.36 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.39
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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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
N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-2-methylcyclopropan-1-amine
CID 62397504
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]-1-pyridazin-3-ylmethanamine
CID 106834011
1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]methanamine
CID 61208162
N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-2,5-dimethylpyrrol-1-amine
CID 79101097
1-(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)-N-[(1-methylcyclopentyl)methyl]methanamine
CID 63820529
1-(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)-N-[(1-methylsulfanylcyclobutyl)methyl]methanamine
CID 107267026
4-[2-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methylamino]ethyl]phenol
CID 61238024
2-(4-chlorophenyl)-N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]ethanamine
CID 43625798
3-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methylamino]-2,3-dimethylbutan-2-ol
CID 106186193

Frequently Asked Questions

What is the IUPAC name of N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-(3,5-dimethyl-1,2-oxazol-4-yl)methanamine?
The IUPAC name of 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) is N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-(3,5-dimethyl-1,2-oxazol-4-yl)methanamine.
What is the SMILES notation for N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-(3,5-dimethyl-1,2-oxazol-4-yl)methanamine?
The canonical SMILES for N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-(3,5-dimethyl-1,2-oxazol-4-yl)methanamine is Cc1cn2c(CNCc3c(C)noc3C)c(C)nc2s1.
What is the InChIKey of N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-(3,5-dimethyl-1,2-oxazol-4-yl)methanamine?
The InChIKey is MEQRLXGXLRAVJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4OS/c1-8-7-18-13(10(3)16-14(18)20-8)6-15-5-12-9(2)17-19-11(12)4/h7,15H,5-6H2,1-4H3.
What are the key properties of N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-(3,5-dimethyl-1,2-oxazol-4-yl)methanamine?
N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-(3,5-dimethyl-1,2-oxazol-4-yl)methanamine has a molecular weight of 290.39 g/mol, XLogP of 2.91, 4 rotatable bonds, 1 hydrogen bond donors, and 6 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-(3,5-dimethyl-1,2-oxazol-4-yl)methanamine is sourced from PubChem (CID 78988134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).