N-[[6-(2-ethylimidazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]-2-methylpropan-1-amine

C15H21N5S — CID 63069814

IUPACN-[[6-(2-ethylimidazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]-2-methylpropan-1-amine
SMILESCCc1nccn1-c1nc2sccn2c1CNCC(C)C
InChIInChI=1S/C15H21N5S/c1-4-13-17-5-6-20(13)14-12(10-16-9-11(2)3)19-7-8-21-15(19)18-14/h5-8,11,16H,4,9-10H2,1-3H3
InChIKeyJHWAEGNQDWOACK-UHFFFAOYSA-N
MW303.44 g/mol
LogP2.89
Rot. Bonds6

About N-[[6-(2-ethylimidazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]-2-methylpropan-1-amine

N-[[6-(2-ethylimidazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]-2-methylpropan-1-amine (PubChem CID 63069814) has the molecular formula C15H21N5S and a molecular weight of 303.44 g/mol. Its IUPAC name is N-[[6-(2-ethylimidazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]-2-methylpropan-1-amine.

Molecular Properties

Compound NameN-[[6-(2-ethylimidazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]-2-methylpropan-1-amine
PubChem CID63069814
Molecular FormulaC15H21N5S
Molecular Weight303.44 g/mol
Exact Mass303.15
IUPAC NameN-[[6-(2-ethylimidazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]-2-methylpropan-1-amine
SMILESCCc1nccn1-c1nc2sccn2c1CNCC(C)C
InChIInChI=1S/C15H21N5S/c1-4-13-17-5-6-20(13)14-12(10-16-9-11(2)3)19-7-8-21-15(19)18-14/h5-8,11,16H,4,9-10H2,1-3H3
InChIKeyJHWAEGNQDWOACK-UHFFFAOYSA-N
XLogP2.89
TPSA47.15 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.44
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[[6-(4,5-dimethylimidazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]-2-methylpropan-1-amine
CID 63071941
2-methyl-N-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]propan-1-amine
CID 43756411
N-[[6-(4,5-dimethylimidazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]ethanamine
CID 62349710
5-[(2-methylpropylamino)methyl]-N,N-dipropylimidazo[2,1-b][1,3]thiazol-6-amine
CID 63059082
N-[(6-tert-butylsulfanylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-2-methylpropan-1-amine
CID 63806411
N-methyl-2-[methyl-[5-[(2-methylpropylamino)methyl]imidazo[2,1-b][1,3]thiazol-6-yl]amino]acetamide
CID 63058784
2-[methyl-[5-[(2-methylpropylamino)methyl]imidazo[2,1-b][1,3]thiazol-6-yl]amino]acetamide
CID 63059665
1-[6-(2-methylimidazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]propan-2-amine
CID 63815708
N-[(6-propan-2-ylsulfanylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]ethanamine
CID 63808415
N-[(6-pyrimidin-2-ylsulfanylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]ethanamine
CID 63805833
N-[(6-pyrazol-1-ylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]propan-2-amine
CID 43476542
N-[[6-(3,4,5-trimethylpiperazin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]ethanamine
CID 114538713

Frequently Asked Questions

What is the IUPAC name of N-[[6-(2-ethylimidazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]-2-methylpropan-1-amine?
The IUPAC name of N-[[6-(2-ethylimidazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]-2-methylpropan-1-amine (CID 63069814) is N-[[6-(2-ethylimidazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]-2-methylpropan-1-amine.
What is the SMILES notation for N-[[6-(2-ethylimidazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]-2-methylpropan-1-amine?
The canonical SMILES for N-[[6-(2-ethylimidazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]-2-methylpropan-1-amine is CCc1nccn1-c1nc2sccn2c1CNCC(C)C.
What is the InChIKey of N-[[6-(2-ethylimidazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]-2-methylpropan-1-amine?
The InChIKey is JHWAEGNQDWOACK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5S/c1-4-13-17-5-6-20(13)14-12(10-16-9-11(2)3)19-7-8-21-15(19)18-14/h5-8,11,16H,4,9-10H2,1-3H3.
What are the key properties of N-[[6-(2-ethylimidazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]-2-methylpropan-1-amine?
N-[[6-(2-ethylimidazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]-2-methylpropan-1-amine has a molecular weight of 303.44 g/mol, XLogP of 2.89, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[6-(2-ethylimidazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]-2-methylpropan-1-amine is sourced from PubChem (CID 63069814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).