5-[1-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide

C15H21N5OS — CID 75373887

About 5-[1-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide

5-[1-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide (PubChem CID 75373887) has the molecular formula C15H21N5OS and a molecular weight of 319.43 g/mol. Its IUPAC name is 5-[1-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide.

Molecular Properties

• Compound Name: 5-[1-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide
• PubChem CID: 75373887
• Molecular Formula: C15H21N5OS
• Molecular Weight: 319.43 g/mol
• Exact Mass: 319.15
• IUPAC Name: 5-[1-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide
• SMILES: Cc1nc(C)c(CN2CCCC(c3cc(C(N)=O)n[nH]3)C2)s1
• InChI: InChI=1S/C15H21N5OS/c1-9-14(22-10(2)17-9)8-20-5-3-4-11(7-20)12-6-13(15(16)21)19-18-12/h6,11H,3-5,7-8H2,1-2H3,(H2,16,21)(H,18,19)
• InChIKey: PHLDGKTZKQZNLS-UHFFFAOYSA-N
• XLogP: 1.96
• TPSA: 87.90 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 5
• Rotatable Bonds: 4
• Heavy Atoms: 22
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	319.43
LogP ≤ 5	1.96
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of 5-[1-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide?

The IUPAC name of 5-[1-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide (CID 75373887) is 5-[1-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide.

What is the SMILES notation for 5-[1-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide?

The canonical SMILES for 5-[1-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide is Cc1nc(C)c(CN2CCCC(c3cc(C(N)=O)n[nH]3)C2)s1.

What is the InChIKey of 5-[1-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide?

The InChIKey is PHLDGKTZKQZNLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5OS/c1-9-14(22-10(2)17-9)8-20-5-3-4-11(7-20)12-6-13(15(16)21)19-18-12/h6,11H,3-5,7-8H2,1-2H3,(H2,16,21)(H,18,19).

What are the key properties of 5-[1-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide?

5-[1-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide has a molecular weight of 319.43 g/mol, XLogP of 1.96, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 5-[1-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 75373887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).