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

C12H15N3O2 — CID 129034353

IUPAC2-methyl-N-[(7-oxo-1H-pyrazolo[1,5-a]pyridin-6-yl)methyl]propanamide
SMILESCC(C)C(=O)NCc1ccc2cc[nH]n2c1=O
InChIInChI=1S/C12H15N3O2/c1-8(2)11(16)13-7-9-3-4-10-5-6-14-15(10)12(9)17/h3-6,8,14H,7H2,1-2H3,(H,13,16)
InChIKeyZOEQYEBILFXVBG-UHFFFAOYSA-N
MW233.27 g/mol
LogP0.90
Rot. Bonds3

About 2-methyl-N-[(7-oxo-1H-pyrazolo[1,5-a]pyridin-6-yl)methyl]propanamide

2-methyl-N-[(7-oxo-1H-pyrazolo[1,5-a]pyridin-6-yl)methyl]propanamide (PubChem CID 129034353) has the molecular formula C12H15N3O2 and a molecular weight of 233.27 g/mol. Its IUPAC name is 2-methyl-N-[(7-oxo-1H-pyrazolo[1,5-a]pyridin-6-yl)methyl]propanamide.

Molecular Properties

Compound Name2-methyl-N-[(7-oxo-1H-pyrazolo[1,5-a]pyridin-6-yl)methyl]propanamide
PubChem CID129034353
Molecular FormulaC12H15N3O2
Molecular Weight233.27 g/mol
Exact Mass233.12
IUPAC Name2-methyl-N-[(7-oxo-1H-pyrazolo[1,5-a]pyridin-6-yl)methyl]propanamide
SMILESCC(C)C(=O)NCc1ccc2cc[nH]n2c1=O
InChIInChI=1S/C12H15N3O2/c1-8(2)11(16)13-7-9-3-4-10-5-6-14-15(10)12(9)17/h3-6,8,14H,7H2,1-2H3,(H,13,16)
InChIKeyZOEQYEBILFXVBG-UHFFFAOYSA-N
XLogP0.90
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 ≤ 50.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(7-oxo-1H-pyrazolo[1,5-a]pyridin-6-yl)methyl]propanamide?
The IUPAC name of 2-methyl-N-[(7-oxo-1H-pyrazolo[1,5-a]pyridin-6-yl)methyl]propanamide (CID 129034353) is 2-methyl-N-[(7-oxo-1H-pyrazolo[1,5-a]pyridin-6-yl)methyl]propanamide.
What is the SMILES notation for 2-methyl-N-[(7-oxo-1H-pyrazolo[1,5-a]pyridin-6-yl)methyl]propanamide?
The canonical SMILES for 2-methyl-N-[(7-oxo-1H-pyrazolo[1,5-a]pyridin-6-yl)methyl]propanamide is CC(C)C(=O)NCc1ccc2cc[nH]n2c1=O.
What is the InChIKey of 2-methyl-N-[(7-oxo-1H-pyrazolo[1,5-a]pyridin-6-yl)methyl]propanamide?
The InChIKey is ZOEQYEBILFXVBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O2/c1-8(2)11(16)13-7-9-3-4-10-5-6-14-15(10)12(9)17/h3-6,8,14H,7H2,1-2H3,(H,13,16).
What are the key properties of 2-methyl-N-[(7-oxo-1H-pyrazolo[1,5-a]pyridin-6-yl)methyl]propanamide?
2-methyl-N-[(7-oxo-1H-pyrazolo[1,5-a]pyridin-6-yl)methyl]propanamide has a molecular weight of 233.27 g/mol, XLogP of 0.90, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(7-oxo-1H-pyrazolo[1,5-a]pyridin-6-yl)methyl]propanamide is sourced from PubChem (CID 129034353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).