N-(5-piperidin-4-yl-1H-pyrazol-3-yl)-[1,3]thiazolo[5,4-b]pyridine-2-carboxamide

C15H16N6OS — CID 167866569

IUPACN-(5-piperidin-4-yl-1H-pyrazol-3-yl)-[1,3]thiazolo[5,4-b]pyridine-2-carboxamide
SMILESO=C(Nc1cc(C2CCNCC2)[nH]n1)c1nc2cccnc2s1
InChIInChI=1S/C15H16N6OS/c22-13(15-18-10-2-1-5-17-14(10)23-15)19-12-8-11(20-21-12)9-3-6-16-7-4-9/h1-2,5,8-9,16H,3-4,6-7H2,(H2,19,20,21,22)
InChIKeyMUAJHPPDQGGNKN-UHFFFAOYSA-N
MW328.40 g/mol
LogP2.13
Rot. Bonds3

About N-(5-piperidin-4-yl-1H-pyrazol-3-yl)-[1,3]thiazolo[5,4-b]pyridine-2-carboxamide

N-(5-piperidin-4-yl-1H-pyrazol-3-yl)-[1,3]thiazolo[5,4-b]pyridine-2-carboxamide (PubChem CID 167866569) has the molecular formula C15H16N6OS and a molecular weight of 328.40 g/mol. Its IUPAC name is N-(5-piperidin-4-yl-1H-pyrazol-3-yl)-[1,3]thiazolo[5,4-b]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(5-piperidin-4-yl-1H-pyrazol-3-yl)-[1,3]thiazolo[5,4-b]pyridine-2-carboxamide
PubChem CID167866569
Molecular FormulaC15H16N6OS
Molecular Weight328.40 g/mol
Exact Mass328.11
IUPAC NameN-(5-piperidin-4-yl-1H-pyrazol-3-yl)-[1,3]thiazolo[5,4-b]pyridine-2-carboxamide
SMILESO=C(Nc1cc(C2CCNCC2)[nH]n1)c1nc2cccnc2s1
InChIInChI=1S/C15H16N6OS/c22-13(15-18-10-2-1-5-17-14(10)23-15)19-12-8-11(20-21-12)9-3-6-16-7-4-9/h1-2,5,8-9,16H,3-4,6-7H2,(H2,19,20,21,22)
InChIKeyMUAJHPPDQGGNKN-UHFFFAOYSA-N
XLogP2.13
TPSA95.59 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.40
LogP ≤ 52.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(5-piperidin-4-yl-1H-pyrazol-3-yl)-[1,3]thiazolo[5,4-b]pyridine-2-carboxamide?
The IUPAC name of N-(5-piperidin-4-yl-1H-pyrazol-3-yl)-[1,3]thiazolo[5,4-b]pyridine-2-carboxamide (CID 167866569) is N-(5-piperidin-4-yl-1H-pyrazol-3-yl)-[1,3]thiazolo[5,4-b]pyridine-2-carboxamide.
What is the SMILES notation for N-(5-piperidin-4-yl-1H-pyrazol-3-yl)-[1,3]thiazolo[5,4-b]pyridine-2-carboxamide?
The canonical SMILES for N-(5-piperidin-4-yl-1H-pyrazol-3-yl)-[1,3]thiazolo[5,4-b]pyridine-2-carboxamide is O=C(Nc1cc(C2CCNCC2)[nH]n1)c1nc2cccnc2s1.
What is the InChIKey of N-(5-piperidin-4-yl-1H-pyrazol-3-yl)-[1,3]thiazolo[5,4-b]pyridine-2-carboxamide?
The InChIKey is MUAJHPPDQGGNKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N6OS/c22-13(15-18-10-2-1-5-17-14(10)23-15)19-12-8-11(20-21-12)9-3-6-16-7-4-9/h1-2,5,8-9,16H,3-4,6-7H2,(H2,19,20,21,22).
What are the key properties of N-(5-piperidin-4-yl-1H-pyrazol-3-yl)-[1,3]thiazolo[5,4-b]pyridine-2-carboxamide?
N-(5-piperidin-4-yl-1H-pyrazol-3-yl)-[1,3]thiazolo[5,4-b]pyridine-2-carboxamide has a molecular weight of 328.40 g/mol, XLogP of 2.13, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-piperidin-4-yl-1H-pyrazol-3-yl)-[1,3]thiazolo[5,4-b]pyridine-2-carboxamide is sourced from PubChem (CID 167866569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).