N-[(3,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-(1,5-dimethylpyrazol-4-yl)ethanamine

C15H21N5S — CID 43792470

IUPACN-[(3,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-(1,5-dimethylpyrazol-4-yl)ethanamine
SMILESCc1nc2scc(C)n2c1CNC(C)c1cnn(C)c1C
InChIInChI=1S/C15H21N5S/c1-9-8-21-15-18-11(3)14(20(9)15)7-16-10(2)13-6-17-19(5)12(13)4/h6,8,10,16H,7H2,1-5H3
InChIKeyUBJPCISNLVCZLI-UHFFFAOYSA-N
MW303.44 g/mol
LogP2.91
Rot. Bonds4

About N-[(3,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-(1,5-dimethylpyrazol-4-yl)ethanamine

N-[(3,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-(1,5-dimethylpyrazol-4-yl)ethanamine (PubChem CID 43792470) has the molecular formula C15H21N5S and a molecular weight of 303.44 g/mol. Its IUPAC name is N-[(3,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-(1,5-dimethylpyrazol-4-yl)ethanamine.

Molecular Properties

Compound NameN-[(3,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-(1,5-dimethylpyrazol-4-yl)ethanamine
PubChem CID43792470
Molecular FormulaC15H21N5S
Molecular Weight303.44 g/mol
Exact Mass303.15
IUPAC NameN-[(3,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-(1,5-dimethylpyrazol-4-yl)ethanamine
SMILESCc1nc2scc(C)n2c1CNC(C)c1cnn(C)c1C
InChIInChI=1S/C15H21N5S/c1-9-8-21-15-18-11(3)14(20(9)15)7-16-10(2)13-6-17-19(5)12(13)4/h6,8,10,16H,7H2,1-5H3
InChIKeyUBJPCISNLVCZLI-UHFFFAOYSA-N
XLogP2.91
TPSA47.15 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.44
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-[(1-cyclopropyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methyl]-2-(1-methylpyrazol-4-yl)-1,3-thiazole
CID 53569000
4-[(1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methyl]-2-(1-methylpyrazol-4-yl)-1,3-thiazole
CID 53581656
6-[[2-(1,3,5-Trimethylpyrazol-4-yl)pyrrolidin-1-yl]methyl]imidazo[2,1-b][1,3]thiazole
CID 72043883
2-[3-(Imidazol-1-ylmethyl)-1-methyl-4,6-dihydropyrrolo[3,4-d]pyrazol-5-yl]-1,3-thiazole
CID 97405323
N-[(1,4-dimethylpyrazol-3-yl)methyl]-1-imidazo[2,1-b][1,3]thiazol-6-ylmethanamine
CID 136558667
2-[[3-(Fluoromethyl)-5-methylpyrazol-1-yl]methyl]-6-methylimidazo[2,1-b][1,3]thiazol-5-amine
CID 156330405
N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-1-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]ethanamine
CID 166302801
2-{1-[2-(3,5-dimethyl-1H-pyrazol-1-yl)ethyl]-1H-imidazol-2-yl}-4-isopropyl-1,3-thiazole
CID 56740090
5-{1-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-1H-imidazol-2-yl}-N,N-dimethyl-1,3-thiazol-2-amine
CID 56862794
2-{1-[(1,5-dimethyl-1H-pyrazol-4-yl)methyl]-1H-imidazol-2-yl}-4-isopropyl-1,3-thiazole
CID 56866331
2-{1-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-1H-imidazol-2-yl}-4-methyl-1,3-thiazole
CID 56867971
N-[[6-(3,5-dimethylpyrazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]cyclopropanamine
CID 43476560

Frequently Asked Questions

What is the IUPAC name of N-[(3,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-(1,5-dimethylpyrazol-4-yl)ethanamine?
The IUPAC name of N-[(3,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-(1,5-dimethylpyrazol-4-yl)ethanamine (CID 43792470) is N-[(3,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-(1,5-dimethylpyrazol-4-yl)ethanamine.
What is the SMILES notation for N-[(3,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-(1,5-dimethylpyrazol-4-yl)ethanamine?
The canonical SMILES for N-[(3,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-(1,5-dimethylpyrazol-4-yl)ethanamine is Cc1nc2scc(C)n2c1CNC(C)c1cnn(C)c1C.
What is the InChIKey of N-[(3,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-(1,5-dimethylpyrazol-4-yl)ethanamine?
The InChIKey is UBJPCISNLVCZLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5S/c1-9-8-21-15-18-11(3)14(20(9)15)7-16-10(2)13-6-17-19(5)12(13)4/h6,8,10,16H,7H2,1-5H3.
What are the key properties of N-[(3,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-(1,5-dimethylpyrazol-4-yl)ethanamine?
N-[(3,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-(1,5-dimethylpyrazol-4-yl)ethanamine has a molecular weight of 303.44 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-[(3,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-(1,5-dimethylpyrazol-4-yl)ethanamine is sourced from PubChem (CID 43792470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).