N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-imidazo[2,1-b][1,3]thiazol-6-ylmethanamine

C12H14N4OS — CID 106371046

IUPACN-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-imidazo[2,1-b][1,3]thiazol-6-ylmethanamine
SMILESCCc1cnc(CNCc2cn3ccsc3n2)o1
InChIInChI=1S/C12H14N4OS/c1-2-10-6-14-11(17-10)7-13-5-9-8-16-3-4-18-12(16)15-9/h3-4,6,8,13H,2,5,7H2,1H3
InChIKeyUTRNFAUTTBRIQT-UHFFFAOYSA-N
MW262.34 g/mol
LogP2.24
Rot. Bonds5

About N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-imidazo[2,1-b][1,3]thiazol-6-ylmethanamine

N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-imidazo[2,1-b][1,3]thiazol-6-ylmethanamine (PubChem CID 106371046) has the molecular formula C12H14N4OS and a molecular weight of 262.34 g/mol. Its IUPAC name is N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-imidazo[2,1-b][1,3]thiazol-6-ylmethanamine.

Molecular Properties

Compound NameN-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-imidazo[2,1-b][1,3]thiazol-6-ylmethanamine
PubChem CID106371046
Molecular FormulaC12H14N4OS
Molecular Weight262.34 g/mol
Exact Mass262.09
IUPAC NameN-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-imidazo[2,1-b][1,3]thiazol-6-ylmethanamine
SMILESCCc1cnc(CNCc2cn3ccsc3n2)o1
InChIInChI=1S/C12H14N4OS/c1-2-10-6-14-11(17-10)7-13-5-9-8-16-3-4-18-12(16)15-9/h3-4,6,8,13H,2,5,7H2,1H3
InChIKeyUTRNFAUTTBRIQT-UHFFFAOYSA-N
XLogP2.24
TPSA55.36 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.34
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-imidazo[2,1-b][1,3]thiazol-6-ylmethanamine with MolForge

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Related Compounds

1-(furan-2-yl)-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)methanamine
CID 78977028
N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-2-methylpropan-1-amine
CID 115331414
N-[(1,5-dimethylpyrazol-4-yl)methyl]-1-imidazo[2,1-b][1,3]thiazol-6-ylmethanamine
CID 103851404
1-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]-3-ethyl-2-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)guanidine
CID 111593007
N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)pentan-3-amine
CID 78925544
2,2-difluoro-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)ethanamine
CID 115406811
methyl 2-(imidazo[2,1-b][1,3]thiazol-6-ylmethylamino)acetate
CID 115331415
N-[(5-chloro-1,3-thiazol-2-yl)methyl]-1-(5-ethyl-1,3-oxazol-2-yl)methanamine
CID 103275061
N-[(1-ethylcyclobutyl)methyl]-1-imidazo[2,1-b][1,3]thiazol-6-ylmethanamine
CID 114107943
N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)butan-2-amine
CID 81333805
3-bromo-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)propan-1-amine
CID 115334551
N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-3-iodopropan-1-amine
CID 114503614

Frequently Asked Questions

What is the IUPAC name of N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-imidazo[2,1-b][1,3]thiazol-6-ylmethanamine?
The IUPAC name of N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-imidazo[2,1-b][1,3]thiazol-6-ylmethanamine (CID 106371046) is N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-imidazo[2,1-b][1,3]thiazol-6-ylmethanamine.
What is the SMILES notation for N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-imidazo[2,1-b][1,3]thiazol-6-ylmethanamine?
The canonical SMILES for N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-imidazo[2,1-b][1,3]thiazol-6-ylmethanamine is CCc1cnc(CNCc2cn3ccsc3n2)o1.
What is the InChIKey of N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-imidazo[2,1-b][1,3]thiazol-6-ylmethanamine?
The InChIKey is UTRNFAUTTBRIQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4OS/c1-2-10-6-14-11(17-10)7-13-5-9-8-16-3-4-18-12(16)15-9/h3-4,6,8,13H,2,5,7H2,1H3.
What are the key properties of N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-imidazo[2,1-b][1,3]thiazol-6-ylmethanamine?
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-imidazo[2,1-b][1,3]thiazol-6-ylmethanamine has a molecular weight of 262.34 g/mol, XLogP of 2.24, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-imidazo[2,1-b][1,3]thiazol-6-ylmethanamine is sourced from PubChem (CID 106371046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).