N-methyl-5-[5-(5-methylfuran-2-yl)-1H-pyrazole-3-carbonyl]-6,7-dihydro-4H-[1,2]oxazolo[4,5-c]pyridine-3-carboxamide

C17H17N5O4 — CID 70740416

About N-methyl-5-[5-(5-methylfuran-2-yl)-1H-pyrazole-3-carbonyl]-6,7-dihydro-4H-[1,2]oxazolo[4,5-c]pyridine-3-carboxamide

N-methyl-5-[5-(5-methylfuran-2-yl)-1H-pyrazole-3-carbonyl]-6,7-dihydro-4H-[1,2]oxazolo[4,5-c]pyridine-3-carboxamide (PubChem CID 70740416) has the molecular formula C17H17N5O4 and a molecular weight of 355.35 g/mol. Its IUPAC name is N-methyl-5-[5-(5-methylfuran-2-yl)-1H-pyrazole-3-carbonyl]-6,7-dihydro-4H-[1,2]oxazolo[4,5-c]pyridine-3-carboxamide.

Molecular Properties

• Compound Name: N-methyl-5-[5-(5-methylfuran-2-yl)-1H-pyrazole-3-carbonyl]-6,7-dihydro-4H-[1,2]oxazolo[4,5-c]pyridine-3-carboxamide
• PubChem CID: 70740416
• Molecular Formula: C17H17N5O4
• Molecular Weight: 355.35 g/mol
• Exact Mass: 355.13
• IUPAC Name: N-methyl-5-[5-(5-methylfuran-2-yl)-1H-pyrazole-3-carbonyl]-6,7-dihydro-4H-[1,2]oxazolo[4,5-c]pyridine-3-carboxamide
• SMILES: CNC(=O)c1noc2c1CN(C(=O)c1cc(-c3ccc(C)o3)[nH]n1)CC2
• InChI: InChI=1S/C17H17N5O4/c1-9-3-4-14(25-9)11-7-12(20-19-11)17(24)22-6-5-13-10(8-22)15(21-26-13)16(23)18-2/h3-4,7H,5-6,8H2,1-2H3,(H,18,23)(H,19,20)
• InChIKey: IPWCEZJJXHWZRG-UHFFFAOYSA-N
• XLogP: 1.52
• TPSA: 117.26 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 6
• Rotatable Bonds: 3
• Heavy Atoms: 26
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	355.35
LogP ≤ 5	1.52
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of N-methyl-5-[5-(5-methylfuran-2-yl)-1H-pyrazole-3-carbonyl]-6,7-dihydro-4H-[1,2]oxazolo[4,5-c]pyridine-3-carboxamide?

The IUPAC name of N-methyl-5-[5-(5-methylfuran-2-yl)-1H-pyrazole-3-carbonyl]-6,7-dihydro-4H-[1,2]oxazolo[4,5-c]pyridine-3-carboxamide (CID 70740416) is N-methyl-5-[5-(5-methylfuran-2-yl)-1H-pyrazole-3-carbonyl]-6,7-dihydro-4H-[1,2]oxazolo[4,5-c]pyridine-3-carboxamide.

What is the SMILES notation for N-methyl-5-[5-(5-methylfuran-2-yl)-1H-pyrazole-3-carbonyl]-6,7-dihydro-4H-[1,2]oxazolo[4,5-c]pyridine-3-carboxamide?

The canonical SMILES for N-methyl-5-[5-(5-methylfuran-2-yl)-1H-pyrazole-3-carbonyl]-6,7-dihydro-4H-[1,2]oxazolo[4,5-c]pyridine-3-carboxamide is CNC(=O)c1noc2c1CN(C(=O)c1cc(-c3ccc(C)o3)[nH]n1)CC2.

What is the InChIKey of N-methyl-5-[5-(5-methylfuran-2-yl)-1H-pyrazole-3-carbonyl]-6,7-dihydro-4H-[1,2]oxazolo[4,5-c]pyridine-3-carboxamide?

The InChIKey is IPWCEZJJXHWZRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N5O4/c1-9-3-4-14(25-9)11-7-12(20-19-11)17(24)22-6-5-13-10(8-22)15(21-26-13)16(23)18-2/h3-4,7H,5-6,8H2,1-2H3,(H,18,23)(H,19,20).

What are the key properties of N-methyl-5-[5-(5-methylfuran-2-yl)-1H-pyrazole-3-carbonyl]-6,7-dihydro-4H-[1,2]oxazolo[4,5-c]pyridine-3-carboxamide?

N-methyl-5-[5-(5-methylfuran-2-yl)-1H-pyrazole-3-carbonyl]-6,7-dihydro-4H-[1,2]oxazolo[4,5-c]pyridine-3-carboxamide has a molecular weight of 355.35 g/mol, XLogP of 1.52, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for N-methyl-5-[5-(5-methylfuran-2-yl)-1H-pyrazole-3-carbonyl]-6,7-dihydro-4H-[1,2]oxazolo[4,5-c]pyridine-3-carboxamide is sourced from PubChem (CID 70740416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).