N-methoxy-N-methyl-4-pyrazolo[1,5-a]pyridin-3-ylbenzamide

C16H15N3O2 — CID 171682360

IUPACN-methoxy-N-methyl-4-pyrazolo[1,5-a]pyridin-3-ylbenzamide
SMILESCON(C)C(=O)c1ccc(-c2cnn3ccccc23)cc1
InChIInChI=1S/C16H15N3O2/c1-18(21-2)16(20)13-8-6-12(7-9-13)14-11-17-19-10-4-3-5-15(14)19/h3-11H,1-2H3
InChIKeyHYKUGDHJCRIXDG-UHFFFAOYSA-N
MW281.32 g/mol
LogP2.63
Rot. Bonds3

About N-methoxy-N-methyl-4-pyrazolo[1,5-a]pyridin-3-ylbenzamide

N-methoxy-N-methyl-4-pyrazolo[1,5-a]pyridin-3-ylbenzamide (PubChem CID 171682360) has the molecular formula C16H15N3O2 and a molecular weight of 281.32 g/mol. Its IUPAC name is N-methoxy-N-methyl-4-pyrazolo[1,5-a]pyridin-3-ylbenzamide.

Molecular Properties

Compound NameN-methoxy-N-methyl-4-pyrazolo[1,5-a]pyridin-3-ylbenzamide
PubChem CID171682360
Molecular FormulaC16H15N3O2
Molecular Weight281.32 g/mol
Exact Mass281.12
IUPAC NameN-methoxy-N-methyl-4-pyrazolo[1,5-a]pyridin-3-ylbenzamide
SMILESCON(C)C(=O)c1ccc(-c2cnn3ccccc23)cc1
InChIInChI=1S/C16H15N3O2/c1-18(21-2)16(20)13-8-6-12(7-9-13)14-11-17-19-10-4-3-5-15(14)19/h3-11H,1-2H3
InChIKeyHYKUGDHJCRIXDG-UHFFFAOYSA-N
XLogP2.63
TPSA46.84 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.32
LogP ≤ 52.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-methoxy-N-methyl-4-pyrazolo[1,5-a]pyridin-3-ylbenzamide?
The IUPAC name of N-methoxy-N-methyl-4-pyrazolo[1,5-a]pyridin-3-ylbenzamide (CID 171682360) is N-methoxy-N-methyl-4-pyrazolo[1,5-a]pyridin-3-ylbenzamide.
What is the SMILES notation for N-methoxy-N-methyl-4-pyrazolo[1,5-a]pyridin-3-ylbenzamide?
The canonical SMILES for N-methoxy-N-methyl-4-pyrazolo[1,5-a]pyridin-3-ylbenzamide is CON(C)C(=O)c1ccc(-c2cnn3ccccc23)cc1.
What is the InChIKey of N-methoxy-N-methyl-4-pyrazolo[1,5-a]pyridin-3-ylbenzamide?
The InChIKey is HYKUGDHJCRIXDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O2/c1-18(21-2)16(20)13-8-6-12(7-9-13)14-11-17-19-10-4-3-5-15(14)19/h3-11H,1-2H3.
What are the key properties of N-methoxy-N-methyl-4-pyrazolo[1,5-a]pyridin-3-ylbenzamide?
N-methoxy-N-methyl-4-pyrazolo[1,5-a]pyridin-3-ylbenzamide has a molecular weight of 281.32 g/mol, XLogP of 2.63, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxy-N-methyl-4-pyrazolo[1,5-a]pyridin-3-ylbenzamide is sourced from PubChem (CID 171682360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).