N-[(5-ethyl-7-oxo-1H-pyrazolo[1,5-a]pyridin-6-yl)methyl]acetamide

C12H15N3O2 — CID 121371021

IUPACN-[(5-ethyl-7-oxo-1H-pyrazolo[1,5-a]pyridin-6-yl)methyl]acetamide
SMILESCCc1cc2cc[nH]n2c(=O)c1CNC(C)=O
InChIInChI=1S/C12H15N3O2/c1-3-9-6-10-4-5-14-15(10)12(17)11(9)7-13-8(2)16/h4-6,14H,3,7H2,1-2H3,(H,13,16)
InChIKeyBIYBVNAEFKMELZ-UHFFFAOYSA-N
MW233.27 g/mol
LogP0.83
Rot. Bonds3

About N-[(5-ethyl-7-oxo-1H-pyrazolo[1,5-a]pyridin-6-yl)methyl]acetamide

N-[(5-ethyl-7-oxo-1H-pyrazolo[1,5-a]pyridin-6-yl)methyl]acetamide (PubChem CID 121371021) has the molecular formula C12H15N3O2 and a molecular weight of 233.27 g/mol. Its IUPAC name is N-[(5-ethyl-7-oxo-1H-pyrazolo[1,5-a]pyridin-6-yl)methyl]acetamide.

Molecular Properties

Compound NameN-[(5-ethyl-7-oxo-1H-pyrazolo[1,5-a]pyridin-6-yl)methyl]acetamide
PubChem CID121371021
Molecular FormulaC12H15N3O2
Molecular Weight233.27 g/mol
Exact Mass233.12
IUPAC NameN-[(5-ethyl-7-oxo-1H-pyrazolo[1,5-a]pyridin-6-yl)methyl]acetamide
SMILESCCc1cc2cc[nH]n2c(=O)c1CNC(C)=O
InChIInChI=1S/C12H15N3O2/c1-3-9-6-10-4-5-14-15(10)12(17)11(9)7-13-8(2)16/h4-6,14H,3,7H2,1-2H3,(H,13,16)
InChIKeyBIYBVNAEFKMELZ-UHFFFAOYSA-N
XLogP0.83
TPSA66.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.27
LogP ≤ 50.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(5-ethyl-7-oxo-1H-pyrazolo[1,5-a]pyridin-6-yl)methyl]acetamide?
The IUPAC name of N-[(5-ethyl-7-oxo-1H-pyrazolo[1,5-a]pyridin-6-yl)methyl]acetamide (CID 121371021) is N-[(5-ethyl-7-oxo-1H-pyrazolo[1,5-a]pyridin-6-yl)methyl]acetamide.
What is the SMILES notation for N-[(5-ethyl-7-oxo-1H-pyrazolo[1,5-a]pyridin-6-yl)methyl]acetamide?
The canonical SMILES for N-[(5-ethyl-7-oxo-1H-pyrazolo[1,5-a]pyridin-6-yl)methyl]acetamide is CCc1cc2cc[nH]n2c(=O)c1CNC(C)=O.
What is the InChIKey of N-[(5-ethyl-7-oxo-1H-pyrazolo[1,5-a]pyridin-6-yl)methyl]acetamide?
The InChIKey is BIYBVNAEFKMELZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O2/c1-3-9-6-10-4-5-14-15(10)12(17)11(9)7-13-8(2)16/h4-6,14H,3,7H2,1-2H3,(H,13,16).
What are the key properties of N-[(5-ethyl-7-oxo-1H-pyrazolo[1,5-a]pyridin-6-yl)methyl]acetamide?
N-[(5-ethyl-7-oxo-1H-pyrazolo[1,5-a]pyridin-6-yl)methyl]acetamide has a molecular weight of 233.27 g/mol, XLogP of 0.83, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-ethyl-7-oxo-1H-pyrazolo[1,5-a]pyridin-6-yl)methyl]acetamide is sourced from PubChem (CID 121371021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).