N-[5-[(2R)-oxolan-2-yl]-1,3,4-thiadiazol-2-yl]-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetamide

C16H22N6O2S — CID 124749945

About N-[5-[(2R)-oxolan-2-yl]-1,3,4-thiadiazol-2-yl]-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetamide

N-[5-[(2R)-oxolan-2-yl]-1,3,4-thiadiazol-2-yl]-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetamide (PubChem CID 124749945) has the molecular formula C16H22N6O2S and a molecular weight of 362.46 g/mol. Its IUPAC name is N-[5-[(2R)-oxolan-2-yl]-1,3,4-thiadiazol-2-yl]-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetamide.

Molecular Properties

• Compound Name: N-[5-[(2R)-oxolan-2-yl]-1,3,4-thiadiazol-2-yl]-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetamide
• PubChem CID: 124749945
• Molecular Formula: C16H22N6O2S
• Molecular Weight: 362.46 g/mol
• Exact Mass: 362.15
• IUPAC Name: N-[5-[(2R)-oxolan-2-yl]-1,3,4-thiadiazol-2-yl]-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetamide
• SMILES: O=C(CN1CCC(c2ccn[nH]2)CC1)Nc1nnc([C@H]2CCCO2)s1
• InChI: InChI=1S/C16H22N6O2S/c23-14(18-16-21-20-15(25-16)13-2-1-9-24-13)10-22-7-4-11(5-8-22)12-3-6-17-19-12/h3,6,11,13H,1-2,4-5,7-10H2,(H,17,19)(H,18,21,23)/t13-/m1/s1
• InChIKey: BTYJMUHZYMUPNX-CYBMUJFWSA-N
• XLogP: 1.93
• TPSA: 96.03 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 7
• Rotatable Bonds: 5
• Heavy Atoms: 25
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	362.46
LogP ≤ 5	1.93
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of N-[5-[(2R)-oxolan-2-yl]-1,3,4-thiadiazol-2-yl]-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetamide?

The IUPAC name of N-[5-[(2R)-oxolan-2-yl]-1,3,4-thiadiazol-2-yl]-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetamide (CID 124749945) is N-[5-[(2R)-oxolan-2-yl]-1,3,4-thiadiazol-2-yl]-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetamide.

What is the SMILES notation for N-[5-[(2R)-oxolan-2-yl]-1,3,4-thiadiazol-2-yl]-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetamide?

The canonical SMILES for N-[5-[(2R)-oxolan-2-yl]-1,3,4-thiadiazol-2-yl]-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetamide is O=C(CN1CCC(c2ccn[nH]2)CC1)Nc1nnc([C@H]2CCCO2)s1.

What is the InChIKey of N-[5-[(2R)-oxolan-2-yl]-1,3,4-thiadiazol-2-yl]-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetamide?

The InChIKey is BTYJMUHZYMUPNX-CYBMUJFWSA-N. The full InChI is InChI=1S/C16H22N6O2S/c23-14(18-16-21-20-15(25-16)13-2-1-9-24-13)10-22-7-4-11(5-8-22)12-3-6-17-19-12/h3,6,11,13H,1-2,4-5,7-10H2,(H,17,19)(H,18,21,23)/t13-/m1/s1.

What are the key properties of N-[5-[(2R)-oxolan-2-yl]-1,3,4-thiadiazol-2-yl]-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetamide?

N-[5-[(2R)-oxolan-2-yl]-1,3,4-thiadiazol-2-yl]-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetamide has a molecular weight of 362.46 g/mol, XLogP of 1.93, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for N-[5-[(2R)-oxolan-2-yl]-1,3,4-thiadiazol-2-yl]-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetamide is sourced from PubChem (CID 124749945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).