1-cyclopropyl-N-ethyl-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-2-amine

C13H19N3S — CID 113289267

IUPAC1-cyclopropyl-N-ethyl-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-2-amine
SMILESCCNC(Cc1cn2ccsc2n1)CC1CC1
InChIInChI=1S/C13H19N3S/c1-2-14-11(7-10-3-4-10)8-12-9-16-5-6-17-13(16)15-12/h5-6,9-11,14H,2-4,7-8H2,1H3
InChIKeyNPNWJVUVMZSCIF-UHFFFAOYSA-N
MW249.38 g/mol
LogP2.72
Rot. Bonds6

About 1-cyclopropyl-N-ethyl-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-2-amine

1-cyclopropyl-N-ethyl-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-2-amine (PubChem CID 113289267) has the molecular formula C13H19N3S and a molecular weight of 249.38 g/mol. Its IUPAC name is 1-cyclopropyl-N-ethyl-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-2-amine.

Molecular Properties

Compound Name1-cyclopropyl-N-ethyl-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-2-amine
PubChem CID113289267
Molecular FormulaC13H19N3S
Molecular Weight249.38 g/mol
Exact Mass249.13
IUPAC Name1-cyclopropyl-N-ethyl-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-2-amine
SMILESCCNC(Cc1cn2ccsc2n1)CC1CC1
InChIInChI=1S/C13H19N3S/c1-2-14-11(7-10-3-4-10)8-12-9-16-5-6-17-13(16)15-12/h5-6,9-11,14H,2-4,7-8H2,1H3
InChIKeyNPNWJVUVMZSCIF-UHFFFAOYSA-N
XLogP2.72
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.38
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-1-(3-ethylcyclopentyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanamine
CID 115333767
1-cyclopropyl-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)propan-2-amine
CID 81333671
N-ethyl-1-imidazo[2,1-b][1,3]thiazol-6-yl-3-propylsulfanylpropan-2-amine
CID 113289225
N-ethyl-1-imidazo[2,1-b][1,3]thiazol-6-yl-3-pyridin-4-ylpropan-2-amine
CID 115333586
N-ethyl-1-(4-fluorophenyl)-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-2-amine
CID 115333461
1-(cyclohexen-1-yl)-N-ethyl-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-2-amine
CID 116661937
4-cyclopentyl-1-imidazo[2,1-b][1,3]thiazol-6-yl-N-propylbutan-2-amine
CID 105023529
[1-(3-ethylcyclopentyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethyl]hydrazine
CID 105233423
2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methyl-1-(oxan-4-yl)ethanamine
CID 115333735
1-(4-butylcyclohexyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanol
CID 115828251
N-[2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(oxolan-3-yl)ethyl]propan-1-amine
CID 115333734
3-imidazo[2,1-b][1,3]thiazol-6-yl-1-N,1-N,2-N-trimethylpropane-1,2-diamine
CID 115333859

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-ethyl-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-2-amine?
The IUPAC name of 1-cyclopropyl-N-ethyl-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-2-amine (CID 113289267) is 1-cyclopropyl-N-ethyl-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-2-amine.
What is the SMILES notation for 1-cyclopropyl-N-ethyl-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-2-amine?
The canonical SMILES for 1-cyclopropyl-N-ethyl-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-2-amine is CCNC(Cc1cn2ccsc2n1)CC1CC1.
What is the InChIKey of 1-cyclopropyl-N-ethyl-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-2-amine?
The InChIKey is NPNWJVUVMZSCIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3S/c1-2-14-11(7-10-3-4-10)8-12-9-16-5-6-17-13(16)15-12/h5-6,9-11,14H,2-4,7-8H2,1H3.
What are the key properties of 1-cyclopropyl-N-ethyl-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-2-amine?
1-cyclopropyl-N-ethyl-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-2-amine has a molecular weight of 249.38 g/mol, XLogP of 2.72, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-ethyl-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-2-amine is sourced from PubChem (CID 113289267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).