5-(5-methoxyfuran-2-carbonyl)-N-methyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide

C14H16N4O4 — CID 91771387

IUPAC5-(5-methoxyfuran-2-carbonyl)-N-methyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide
SMILESCNC(=O)c1n[nH]c2c1CN(C(=O)c1ccc(OC)o1)CC2
InChIInChI=1S/C14H16N4O4/c1-15-13(19)12-8-7-18(6-5-9(8)16-17-12)14(20)10-3-4-11(21-2)22-10/h3-4H,5-7H2,1-2H3,(H,15,19)(H,16,17)
InChIKeyJOKYTJCBXVBXRS-UHFFFAOYSA-N
MW304.31 g/mol
LogP0.57
Rot. Bonds3

About 5-(5-methoxyfuran-2-carbonyl)-N-methyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide

5-(5-methoxyfuran-2-carbonyl)-N-methyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide (PubChem CID 91771387) has the molecular formula C14H16N4O4 and a molecular weight of 304.31 g/mol. Its IUPAC name is 5-(5-methoxyfuran-2-carbonyl)-N-methyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide.

Molecular Properties

Compound Name5-(5-methoxyfuran-2-carbonyl)-N-methyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide
PubChem CID91771387
Molecular FormulaC14H16N4O4
Molecular Weight304.31 g/mol
Exact Mass304.12
IUPAC Name5-(5-methoxyfuran-2-carbonyl)-N-methyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide
SMILESCNC(=O)c1n[nH]c2c1CN(C(=O)c1ccc(OC)o1)CC2
InChIInChI=1S/C14H16N4O4/c1-15-13(19)12-8-7-18(6-5-9(8)16-17-12)14(20)10-3-4-11(21-2)22-10/h3-4H,5-7H2,1-2H3,(H,15,19)(H,16,17)
InChIKeyJOKYTJCBXVBXRS-UHFFFAOYSA-N
XLogP0.57
TPSA100.46 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.31
LogP ≤ 50.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-(5-methoxyfuran-2-carbonyl)-N-methyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide?
The IUPAC name of 5-(5-methoxyfuran-2-carbonyl)-N-methyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide (CID 91771387) is 5-(5-methoxyfuran-2-carbonyl)-N-methyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide.
What is the SMILES notation for 5-(5-methoxyfuran-2-carbonyl)-N-methyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide?
The canonical SMILES for 5-(5-methoxyfuran-2-carbonyl)-N-methyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide is CNC(=O)c1n[nH]c2c1CN(C(=O)c1ccc(OC)o1)CC2.
What is the InChIKey of 5-(5-methoxyfuran-2-carbonyl)-N-methyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide?
The InChIKey is JOKYTJCBXVBXRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4O4/c1-15-13(19)12-8-7-18(6-5-9(8)16-17-12)14(20)10-3-4-11(21-2)22-10/h3-4H,5-7H2,1-2H3,(H,15,19)(H,16,17).
What are the key properties of 5-(5-methoxyfuran-2-carbonyl)-N-methyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide?
5-(5-methoxyfuran-2-carbonyl)-N-methyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide has a molecular weight of 304.31 g/mol, XLogP of 0.57, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(5-methoxyfuran-2-carbonyl)-N-methyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide is sourced from PubChem (CID 91771387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).