1-(2-ethyl-5-methylpyrazol-3-yl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanamine

C13H17N5S — CID 105174148

IUPAC1-(2-ethyl-5-methylpyrazol-3-yl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanamine
SMILESCCn1nc(C)cc1C(N)Cc1cn2ccsc2n1
InChIInChI=1S/C13H17N5S/c1-3-18-12(6-9(2)16-18)11(14)7-10-8-17-4-5-19-13(17)15-10/h4-6,8,11H,3,7,14H2,1-2H3
InChIKeyOLBGGNKPTPKKPC-UHFFFAOYSA-N
MW275.38 g/mol
LogP2.16
Rot. Bonds4

About 1-(2-ethyl-5-methylpyrazol-3-yl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanamine

1-(2-ethyl-5-methylpyrazol-3-yl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanamine (PubChem CID 105174148) has the molecular formula C13H17N5S and a molecular weight of 275.38 g/mol. Its IUPAC name is 1-(2-ethyl-5-methylpyrazol-3-yl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanamine.

Molecular Properties

Compound Name1-(2-ethyl-5-methylpyrazol-3-yl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanamine
PubChem CID105174148
Molecular FormulaC13H17N5S
Molecular Weight275.38 g/mol
Exact Mass275.12
IUPAC Name1-(2-ethyl-5-methylpyrazol-3-yl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanamine
SMILESCCn1nc(C)cc1C(N)Cc1cn2ccsc2n1
InChIInChI=1S/C13H17N5S/c1-3-18-12(6-9(2)16-18)11(14)7-10-8-17-4-5-19-13(17)15-10/h4-6,8,11H,3,7,14H2,1-2H3
InChIKeyOLBGGNKPTPKKPC-UHFFFAOYSA-N
XLogP2.16
TPSA61.14 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.38
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1-imidazo[2,1-b][1,3]thiazol-6-yl-3-propylhexan-2-amine
CID 105023692
2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(1-methylimidazol-4-yl)ethanamine
CID 107976895
2-imidazo[2,1-b][1,3]thiazol-6-yl-1-pyrimidin-2-ylethanamine
CID 115333425
1-imidazo[2,1-b][1,3]thiazol-6-yl-4-methylpentan-2-amine
CID 115333412
2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(2-methoxy-5-methylphenyl)ethanamine
CID 105023464
2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(4-propan-2-ylphenyl)ethanamine
CID 115333398
1-(4-tert-butylphenyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanamine
CID 105023719
2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(3-propoxyphenyl)ethanamine
CID 105023564
1-(2,5-dichlorophenyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanamine
CID 105023602
1-imidazo[2,1-b][1,3]thiazol-6-yl-3-propan-2-ylsulfanylpropan-2-amine
CID 115333704
1-(5-bromothiophen-2-yl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanamine
CID 115333678
1-imidazo[2,1-b][1,3]thiazol-6-yl-4-methoxybutan-2-amine
CID 115333521

Frequently Asked Questions

What is the IUPAC name of 1-(2-ethyl-5-methylpyrazol-3-yl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanamine?
The IUPAC name of 1-(2-ethyl-5-methylpyrazol-3-yl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanamine (CID 105174148) is 1-(2-ethyl-5-methylpyrazol-3-yl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanamine.
What is the SMILES notation for 1-(2-ethyl-5-methylpyrazol-3-yl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanamine?
The canonical SMILES for 1-(2-ethyl-5-methylpyrazol-3-yl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanamine is CCn1nc(C)cc1C(N)Cc1cn2ccsc2n1.
What is the InChIKey of 1-(2-ethyl-5-methylpyrazol-3-yl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanamine?
The InChIKey is OLBGGNKPTPKKPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N5S/c1-3-18-12(6-9(2)16-18)11(14)7-10-8-17-4-5-19-13(17)15-10/h4-6,8,11H,3,7,14H2,1-2H3.
What are the key properties of 1-(2-ethyl-5-methylpyrazol-3-yl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanamine?
1-(2-ethyl-5-methylpyrazol-3-yl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanamine has a molecular weight of 275.38 g/mol, XLogP of 2.16, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethyl-5-methylpyrazol-3-yl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanamine is sourced from PubChem (CID 105174148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).