N-cyclopropyl-5-(6-methylimidazo[2,1-b][1,3]thiazole-5-carbonyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-2-carboxamide

C17H18N6O2S — CID 50984047

IUPACN-cyclopropyl-5-(6-methylimidazo[2,1-b][1,3]thiazole-5-carbonyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-2-carboxamide
SMILESCc1nc2sccn2c1C(=O)N1CCn2nc(C(=O)NC3CC3)cc2C1
InChIInChI=1S/C17H18N6O2S/c1-10-14(22-6-7-26-17(22)18-10)16(25)21-4-5-23-12(9-21)8-13(20-23)15(24)19-11-2-3-11/h6-8,11H,2-5,9H2,1H3,(H,19,24)
InChIKeyJCSVSBPLCDLQPY-UHFFFAOYSA-N
MW370.44 g/mol
LogP1.45
Rot. Bonds3

About N-cyclopropyl-5-(6-methylimidazo[2,1-b][1,3]thiazole-5-carbonyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-2-carboxamide

N-cyclopropyl-5-(6-methylimidazo[2,1-b][1,3]thiazole-5-carbonyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-2-carboxamide (PubChem CID 50984047) has the molecular formula C17H18N6O2S and a molecular weight of 370.44 g/mol. Its IUPAC name is N-cyclopropyl-5-(6-methylimidazo[2,1-b][1,3]thiazole-5-carbonyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-5-(6-methylimidazo[2,1-b][1,3]thiazole-5-carbonyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-2-carboxamide
PubChem CID50984047
Molecular FormulaC17H18N6O2S
Molecular Weight370.44 g/mol
Exact Mass370.12
IUPAC NameN-cyclopropyl-5-(6-methylimidazo[2,1-b][1,3]thiazole-5-carbonyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-2-carboxamide
SMILESCc1nc2sccn2c1C(=O)N1CCn2nc(C(=O)NC3CC3)cc2C1
InChIInChI=1S/C17H18N6O2S/c1-10-14(22-6-7-26-17(22)18-10)16(25)21-4-5-23-12(9-21)8-13(20-23)15(24)19-11-2-3-11/h6-8,11H,2-5,9H2,1H3,(H,19,24)
InChIKeyJCSVSBPLCDLQPY-UHFFFAOYSA-N
XLogP1.45
TPSA84.53 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.44
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-5-(6-methylimidazo[2,1-b][1,3]thiazole-5-carbonyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-2-carboxamide?
The IUPAC name of N-cyclopropyl-5-(6-methylimidazo[2,1-b][1,3]thiazole-5-carbonyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-2-carboxamide (CID 50984047) is N-cyclopropyl-5-(6-methylimidazo[2,1-b][1,3]thiazole-5-carbonyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-2-carboxamide.
What is the SMILES notation for N-cyclopropyl-5-(6-methylimidazo[2,1-b][1,3]thiazole-5-carbonyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-2-carboxamide?
The canonical SMILES for N-cyclopropyl-5-(6-methylimidazo[2,1-b][1,3]thiazole-5-carbonyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-2-carboxamide is Cc1nc2sccn2c1C(=O)N1CCn2nc(C(=O)NC3CC3)cc2C1.
What is the InChIKey of N-cyclopropyl-5-(6-methylimidazo[2,1-b][1,3]thiazole-5-carbonyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-2-carboxamide?
The InChIKey is JCSVSBPLCDLQPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N6O2S/c1-10-14(22-6-7-26-17(22)18-10)16(25)21-4-5-23-12(9-21)8-13(20-23)15(24)19-11-2-3-11/h6-8,11H,2-5,9H2,1H3,(H,19,24).
What are the key properties of N-cyclopropyl-5-(6-methylimidazo[2,1-b][1,3]thiazole-5-carbonyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-2-carboxamide?
N-cyclopropyl-5-(6-methylimidazo[2,1-b][1,3]thiazole-5-carbonyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-2-carboxamide has a molecular weight of 370.44 g/mol, XLogP of 1.45, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-5-(6-methylimidazo[2,1-b][1,3]thiazole-5-carbonyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-2-carboxamide is sourced from PubChem (CID 50984047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).