N-[2-[(7S)-5-(furan-3-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]ethyl]pyridine-3-carboxamide

C19H21N5O2 — CID 124781266

About N-[2-[(7S)-5-(furan-3-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]ethyl]pyridine-3-carboxamide

N-[2-[(7S)-5-(furan-3-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]ethyl]pyridine-3-carboxamide (PubChem CID 124781266) has the molecular formula C19H21N5O2 and a molecular weight of 351.41 g/mol. Its IUPAC name is N-[2-[(7S)-5-(furan-3-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]ethyl]pyridine-3-carboxamide.

Molecular Properties

• Compound Name: N-[2-[(7S)-5-(furan-3-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]ethyl]pyridine-3-carboxamide
• PubChem CID: 124781266
• Molecular Formula: C19H21N5O2
• Molecular Weight: 351.41 g/mol
• Exact Mass: 351.17
• IUPAC Name: N-[2-[(7S)-5-(furan-3-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]ethyl]pyridine-3-carboxamide
• SMILES: O=C(NCC[C@H]1CN(Cc2ccoc2)Cc2ccnn21)c1cccnc1
• InChI: InChI=1S/C19H21N5O2/c25-19(16-2-1-6-20-10-16)21-7-3-17-12-23(11-15-5-9-26-14-15)13-18-4-8-22-24(17)18/h1-2,4-6,8-10,14,17H,3,7,11-13H2,(H,21,25)/t17-/m0/s1
• InChIKey: DIUFHTIWWRYULG-KRWDZBQOSA-N
• XLogP: 2.25
• TPSA: 76.19 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 6
• Rotatable Bonds: 6
• Heavy Atoms: 26
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	351.41
LogP ≤ 5	2.25
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of N-[2-[(7S)-5-(furan-3-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]ethyl]pyridine-3-carboxamide?

The IUPAC name of N-[2-[(7S)-5-(furan-3-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]ethyl]pyridine-3-carboxamide (CID 124781266) is N-[2-[(7S)-5-(furan-3-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]ethyl]pyridine-3-carboxamide.

What is the SMILES notation for N-[2-[(7S)-5-(furan-3-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]ethyl]pyridine-3-carboxamide?

The canonical SMILES for N-[2-[(7S)-5-(furan-3-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]ethyl]pyridine-3-carboxamide is O=C(NCC[C@H]1CN(Cc2ccoc2)Cc2ccnn21)c1cccnc1.

What is the InChIKey of N-[2-[(7S)-5-(furan-3-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]ethyl]pyridine-3-carboxamide?

The InChIKey is DIUFHTIWWRYULG-KRWDZBQOSA-N. The full InChI is InChI=1S/C19H21N5O2/c25-19(16-2-1-6-20-10-16)21-7-3-17-12-23(11-15-5-9-26-14-15)13-18-4-8-22-24(17)18/h1-2,4-6,8-10,14,17H,3,7,11-13H2,(H,21,25)/t17-/m0/s1.

What are the key properties of N-[2-[(7S)-5-(furan-3-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]ethyl]pyridine-3-carboxamide?

N-[2-[(7S)-5-(furan-3-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]ethyl]pyridine-3-carboxamide has a molecular weight of 351.41 g/mol, XLogP of 2.25, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for N-[2-[(7S)-5-(furan-3-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]ethyl]pyridine-3-carboxamide is sourced from PubChem (CID 124781266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).