6-[[2-[(4-methylpyrazol-1-yl)methyl]pyrrolidin-1-yl]methyl]imidazo[2,1-b][1,3]thiazole

C15H19N5S — CID 56780532

IUPAC6-[[2-[(4-methylpyrazol-1-yl)methyl]pyrrolidin-1-yl]methyl]imidazo[2,1-b][1,3]thiazole
SMILESCc1cnn(CC2CCCN2Cc2cn3ccsc3n2)c1
InChIInChI=1S/C15H19N5S/c1-12-7-16-20(8-12)11-14-3-2-4-18(14)9-13-10-19-5-6-21-15(19)17-13/h5-8,10,14H,2-4,9,11H2,1H3
InChIKeyRDBLQZSOSNGNDK-UHFFFAOYSA-N
MW301.42 g/mol
LogP2.57
Rot. Bonds4

About 6-[[2-[(4-methylpyrazol-1-yl)methyl]pyrrolidin-1-yl]methyl]imidazo[2,1-b][1,3]thiazole

6-[[2-[(4-methylpyrazol-1-yl)methyl]pyrrolidin-1-yl]methyl]imidazo[2,1-b][1,3]thiazole (PubChem CID 56780532) has the molecular formula C15H19N5S and a molecular weight of 301.42 g/mol. Its IUPAC name is 6-[[2-[(4-methylpyrazol-1-yl)methyl]pyrrolidin-1-yl]methyl]imidazo[2,1-b][1,3]thiazole.

Molecular Properties

Compound Name6-[[2-[(4-methylpyrazol-1-yl)methyl]pyrrolidin-1-yl]methyl]imidazo[2,1-b][1,3]thiazole
PubChem CID56780532
Molecular FormulaC15H19N5S
Molecular Weight301.42 g/mol
Exact Mass301.14
IUPAC Name6-[[2-[(4-methylpyrazol-1-yl)methyl]pyrrolidin-1-yl]methyl]imidazo[2,1-b][1,3]thiazole
SMILESCc1cnn(CC2CCCN2Cc2cn3ccsc3n2)c1
InChIInChI=1S/C15H19N5S/c1-12-7-16-20(8-12)11-14-3-2-4-18(14)9-13-10-19-5-6-21-15(19)17-13/h5-8,10,14H,2-4,9,11H2,1H3
InChIKeyRDBLQZSOSNGNDK-UHFFFAOYSA-N
XLogP2.57
TPSA38.36 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.42
LogP ≤ 52.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-[[2-[(4-methylpyrazol-1-yl)methyl]pyrrolidin-1-yl]methyl]imidazo[2,1-b][1,3]thiazole?
The IUPAC name of 6-[[2-[(4-methylpyrazol-1-yl)methyl]pyrrolidin-1-yl]methyl]imidazo[2,1-b][1,3]thiazole (CID 56780532) is 6-[[2-[(4-methylpyrazol-1-yl)methyl]pyrrolidin-1-yl]methyl]imidazo[2,1-b][1,3]thiazole.
What is the SMILES notation for 6-[[2-[(4-methylpyrazol-1-yl)methyl]pyrrolidin-1-yl]methyl]imidazo[2,1-b][1,3]thiazole?
The canonical SMILES for 6-[[2-[(4-methylpyrazol-1-yl)methyl]pyrrolidin-1-yl]methyl]imidazo[2,1-b][1,3]thiazole is Cc1cnn(CC2CCCN2Cc2cn3ccsc3n2)c1.
What is the InChIKey of 6-[[2-[(4-methylpyrazol-1-yl)methyl]pyrrolidin-1-yl]methyl]imidazo[2,1-b][1,3]thiazole?
The InChIKey is RDBLQZSOSNGNDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5S/c1-12-7-16-20(8-12)11-14-3-2-4-18(14)9-13-10-19-5-6-21-15(19)17-13/h5-8,10,14H,2-4,9,11H2,1H3.
What are the key properties of 6-[[2-[(4-methylpyrazol-1-yl)methyl]pyrrolidin-1-yl]methyl]imidazo[2,1-b][1,3]thiazole?
6-[[2-[(4-methylpyrazol-1-yl)methyl]pyrrolidin-1-yl]methyl]imidazo[2,1-b][1,3]thiazole has a molecular weight of 301.42 g/mol, XLogP of 2.57, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[2-[(4-methylpyrazol-1-yl)methyl]pyrrolidin-1-yl]methyl]imidazo[2,1-b][1,3]thiazole is sourced from PubChem (CID 56780532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).