2-(1-ethyl-3-methyl-7-oxopyrazolo[5,4-c]pyridin-6-yl)-N-(furan-2-ylmethyl)acetamide

C16H18N4O3 — CID 46395088

IUPAC2-(1-ethyl-3-methyl-7-oxopyrazolo[5,4-c]pyridin-6-yl)-N-(furan-2-ylmethyl)acetamide
SMILESCCn1nc(C)c2ccn(CC(=O)NCc3ccco3)c(=O)c21
InChIInChI=1S/C16H18N4O3/c1-3-20-15-13(11(2)18-20)6-7-19(16(15)22)10-14(21)17-9-12-5-4-8-23-12/h4-8H,3,9-10H2,1-2H3,(H,17,21)
InChIKeySKZMXUFMGXDSBT-UHFFFAOYSA-N
MW314.35 g/mol
LogP1.44
Rot. Bonds5

About 2-(1-ethyl-3-methyl-7-oxopyrazolo[5,4-c]pyridin-6-yl)-N-(furan-2-ylmethyl)acetamide

2-(1-ethyl-3-methyl-7-oxopyrazolo[5,4-c]pyridin-6-yl)-N-(furan-2-ylmethyl)acetamide (PubChem CID 46395088) has the molecular formula C16H18N4O3 and a molecular weight of 314.35 g/mol. Its IUPAC name is 2-(1-ethyl-3-methyl-7-oxopyrazolo[5,4-c]pyridin-6-yl)-N-(furan-2-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(1-ethyl-3-methyl-7-oxopyrazolo[5,4-c]pyridin-6-yl)-N-(furan-2-ylmethyl)acetamide
PubChem CID46395088
Molecular FormulaC16H18N4O3
Molecular Weight314.35 g/mol
Exact Mass314.14
IUPAC Name2-(1-ethyl-3-methyl-7-oxopyrazolo[5,4-c]pyridin-6-yl)-N-(furan-2-ylmethyl)acetamide
SMILESCCn1nc(C)c2ccn(CC(=O)NCc3ccco3)c(=O)c21
InChIInChI=1S/C16H18N4O3/c1-3-20-15-13(11(2)18-20)6-7-19(16(15)22)10-14(21)17-9-12-5-4-8-23-12/h4-8H,3,9-10H2,1-2H3,(H,17,21)
InChIKeySKZMXUFMGXDSBT-UHFFFAOYSA-N
XLogP1.44
TPSA82.06 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.35
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-(1-ethyl-3-methyl-7-oxopyrazolo[5,4-c]pyridin-6-yl)-N-(furan-2-ylmethyl)acetamide with MolForge

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Related Compounds

2-(1-ethyl-3-methyl-7-oxopyrazolo[5,4-c]pyridin-6-yl)-N-(2-methoxyethyl)acetamide
CID 46395102
N-butan-2-yl-2-(1-ethyl-3-methyl-7-oxopyrazolo[5,4-c]pyridin-6-yl)acetamide
CID 46395084
N-[(4-butoxyphenyl)methyl]-2-(1-ethyl-3-methyl-7-oxopyrazolo[5,4-c]pyridin-6-yl)acetamide
CID 46395124
N-(furan-2-ylmethyl)-2-(7-methyl-4-oxo-2-phenyl-3-pyrrol-1-ylpyrazolo[3,4-d]pyridazin-5-yl)acetamide
CID 46350170
N-(furan-2-ylmethyl)-2-(4-methyl-6-oxopyrimidin-1-yl)acetamide
CID 45496929
2-(5,6-dimethyl-4-oxofuro[2,3-d]pyrimidin-3-yl)-N-(furan-2-ylmethyl)acetamide
CID 53023985
N-(furan-2-ylmethyl)-2-[2-(4-methylphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5-yl]acetamide
CID 16956925
N-(furan-2-ylmethyl)-2-pyrrol-1-ylacetamide
CID 110688542
2-(2-amino-4,5-dimethyl-6-oxopyrimidin-1-yl)-N-(furan-2-ylmethyl)acetamide
CID 95857463
2-[4-(1,1-dihydroxypropyl)-3-methyl-5-methylsulfanylpyrazol-1-yl]-N-(furan-2-ylmethyl)acetamide
CID 72709740
2-[[5-(1-ethyl-2-oxo-3-pyridinyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(furan-2-ylmethyl)acetamide
CID 30859736
2-[1-(4-ethylphenyl)-3,4-dimethyl-6-oxopyrazolo[5,4-b]pyridin-7-yl]-N-(furan-2-ylmethyl)acetamide
CID 20944128

Frequently Asked Questions

What is the IUPAC name of 2-(1-ethyl-3-methyl-7-oxopyrazolo[5,4-c]pyridin-6-yl)-N-(furan-2-ylmethyl)acetamide?
The IUPAC name of 2-(1-ethyl-3-methyl-7-oxopyrazolo[5,4-c]pyridin-6-yl)-N-(furan-2-ylmethyl)acetamide (CID 46395088) is 2-(1-ethyl-3-methyl-7-oxopyrazolo[5,4-c]pyridin-6-yl)-N-(furan-2-ylmethyl)acetamide.
What is the SMILES notation for 2-(1-ethyl-3-methyl-7-oxopyrazolo[5,4-c]pyridin-6-yl)-N-(furan-2-ylmethyl)acetamide?
The canonical SMILES for 2-(1-ethyl-3-methyl-7-oxopyrazolo[5,4-c]pyridin-6-yl)-N-(furan-2-ylmethyl)acetamide is CCn1nc(C)c2ccn(CC(=O)NCc3ccco3)c(=O)c21.
What is the InChIKey of 2-(1-ethyl-3-methyl-7-oxopyrazolo[5,4-c]pyridin-6-yl)-N-(furan-2-ylmethyl)acetamide?
The InChIKey is SKZMXUFMGXDSBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4O3/c1-3-20-15-13(11(2)18-20)6-7-19(16(15)22)10-14(21)17-9-12-5-4-8-23-12/h4-8H,3,9-10H2,1-2H3,(H,17,21).
What are the key properties of 2-(1-ethyl-3-methyl-7-oxopyrazolo[5,4-c]pyridin-6-yl)-N-(furan-2-ylmethyl)acetamide?
2-(1-ethyl-3-methyl-7-oxopyrazolo[5,4-c]pyridin-6-yl)-N-(furan-2-ylmethyl)acetamide has a molecular weight of 314.35 g/mol, XLogP of 1.44, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-ethyl-3-methyl-7-oxopyrazolo[5,4-c]pyridin-6-yl)-N-(furan-2-ylmethyl)acetamide is sourced from PubChem (CID 46395088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).