6-[3-hydroxy-5-[2-[(2S)-piperidin-2-yl]ethyl]phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide

C20H23N5O2 — CID 95719143

About 6-[3-hydroxy-5-[2-[(2S)-piperidin-2-yl]ethyl]phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide

6-[3-hydroxy-5-[2-[(2S)-piperidin-2-yl]ethyl]phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 95719143) has the molecular formula C20H23N5O2 and a molecular weight of 365.44 g/mol. Its IUPAC name is 6-[3-hydroxy-5-[2-[(2S)-piperidin-2-yl]ethyl]phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

• Compound Name: 6-[3-hydroxy-5-[2-[(2S)-piperidin-2-yl]ethyl]phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
• PubChem CID: 95719143
• Molecular Formula: C20H23N5O2
• Molecular Weight: 365.44 g/mol
• Exact Mass: 365.19
• IUPAC Name: 6-[3-hydroxy-5-[2-[(2S)-piperidin-2-yl]ethyl]phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
• SMILES: NC(=O)c1cnn2cc(-c3cc(O)cc(CC[C@@H]4CCCCN4)c3)cnc12
• InChI: InChI=1S/C20H23N5O2/c21-19(27)18-11-24-25-12-15(10-23-20(18)25)14-7-13(8-17(26)9-14)4-5-16-3-1-2-6-22-16/h7-12,16,22,26H,1-6H2,(H2,21,27)/t16-/m0/s1
• InChIKey: WXSGFZHPWKUFEP-INIZCTEOSA-N
• XLogP: 2.28
• TPSA: 105.54 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 6
• Rotatable Bonds: 5
• Heavy Atoms: 27
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	365.44
LogP ≤ 5	2.28
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 6-[3-hydroxy-5-[2-[(2S)-piperidin-2-yl]ethyl]phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?

The IUPAC name of 6-[3-hydroxy-5-[2-[(2S)-piperidin-2-yl]ethyl]phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 95719143) is 6-[3-hydroxy-5-[2-[(2S)-piperidin-2-yl]ethyl]phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide.

What is the SMILES notation for 6-[3-hydroxy-5-[2-[(2S)-piperidin-2-yl]ethyl]phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?

The canonical SMILES for 6-[3-hydroxy-5-[2-[(2S)-piperidin-2-yl]ethyl]phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide is NC(=O)c1cnn2cc(-c3cc(O)cc(CC[C@@H]4CCCCN4)c3)cnc12.

What is the InChIKey of 6-[3-hydroxy-5-[2-[(2S)-piperidin-2-yl]ethyl]phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?

The InChIKey is WXSGFZHPWKUFEP-INIZCTEOSA-N. The full InChI is InChI=1S/C20H23N5O2/c21-19(27)18-11-24-25-12-15(10-23-20(18)25)14-7-13(8-17(26)9-14)4-5-16-3-1-2-6-22-16/h7-12,16,22,26H,1-6H2,(H2,21,27)/t16-/m0/s1.

What are the key properties of 6-[3-hydroxy-5-[2-[(2S)-piperidin-2-yl]ethyl]phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?

6-[3-hydroxy-5-[2-[(2S)-piperidin-2-yl]ethyl]phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 365.44 g/mol, XLogP of 2.28, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 6-[3-hydroxy-5-[2-[(2S)-piperidin-2-yl]ethyl]phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 95719143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).