5-[1-[3-(1,3-thiazol-4-yl)propanoyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide

C15H19N5O2S — CID 71926909

IUPAC5-[1-[3-(1,3-thiazol-4-yl)propanoyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide
SMILESNC(=O)c1cc(C2CCCN(C(=O)CCc3cscn3)C2)[nH]n1
InChIInChI=1S/C15H19N5O2S/c16-15(22)13-6-12(18-19-13)10-2-1-5-20(7-10)14(21)4-3-11-8-23-9-17-11/h6,8-10H,1-5,7H2,(H2,16,22)(H,18,19)
InChIKeyXQYFQLSPJUTXRZ-UHFFFAOYSA-N
MW333.42 g/mol
LogP1.30
Rot. Bonds5

About 5-[1-[3-(1,3-thiazol-4-yl)propanoyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide

5-[1-[3-(1,3-thiazol-4-yl)propanoyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide (PubChem CID 71926909) has the molecular formula C15H19N5O2S and a molecular weight of 333.42 g/mol. Its IUPAC name is 5-[1-[3-(1,3-thiazol-4-yl)propanoyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound Name5-[1-[3-(1,3-thiazol-4-yl)propanoyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide
PubChem CID71926909
Molecular FormulaC15H19N5O2S
Molecular Weight333.42 g/mol
Exact Mass333.13
IUPAC Name5-[1-[3-(1,3-thiazol-4-yl)propanoyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide
SMILESNC(=O)c1cc(C2CCCN(C(=O)CCc3cscn3)C2)[nH]n1
InChIInChI=1S/C15H19N5O2S/c16-15(22)13-6-12(18-19-13)10-2-1-5-20(7-10)14(21)4-3-11-8-23-9-17-11/h6,8-10H,1-5,7H2,(H2,16,22)(H,18,19)
InChIKeyXQYFQLSPJUTXRZ-UHFFFAOYSA-N
XLogP1.30
TPSA104.97 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.42
LogP ≤ 51.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 5-[1-[3-(1,3-thiazol-4-yl)propanoyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-[1-[3-(1,3-thiazol-4-yl)propanoyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide?
The IUPAC name of 5-[1-[3-(1,3-thiazol-4-yl)propanoyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide (CID 71926909) is 5-[1-[3-(1,3-thiazol-4-yl)propanoyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide.
What is the SMILES notation for 5-[1-[3-(1,3-thiazol-4-yl)propanoyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide?
The canonical SMILES for 5-[1-[3-(1,3-thiazol-4-yl)propanoyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide is NC(=O)c1cc(C2CCCN(C(=O)CCc3cscn3)C2)[nH]n1.
What is the InChIKey of 5-[1-[3-(1,3-thiazol-4-yl)propanoyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide?
The InChIKey is XQYFQLSPJUTXRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5O2S/c16-15(22)13-6-12(18-19-13)10-2-1-5-20(7-10)14(21)4-3-11-8-23-9-17-11/h6,8-10H,1-5,7H2,(H2,16,22)(H,18,19).
What are the key properties of 5-[1-[3-(1,3-thiazol-4-yl)propanoyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide?
5-[1-[3-(1,3-thiazol-4-yl)propanoyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide has a molecular weight of 333.42 g/mol, XLogP of 1.30, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[1-[3-(1,3-thiazol-4-yl)propanoyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 71926909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).