2-(6-chloro-4-ethoxypyrazolo[4,3-c]pyridin-1-yl)-N-hydroxyacetamide

C10H11ClN4O3 — CID 175944893

IUPAC2-(6-chloro-4-ethoxypyrazolo[4,3-c]pyridin-1-yl)-N-hydroxyacetamide
SMILESCCOc1nc(Cl)cc2c1cnn2CC(=O)NO
InChIInChI=1S/C10H11ClN4O3/c1-2-18-10-6-4-12-15(5-9(16)14-17)7(6)3-8(11)13-10/h3-4,17H,2,5H2,1H3,(H,14,16)
InChIKeyDHJUDIXZQFIJDK-UHFFFAOYSA-N
MW270.68 g/mol
LogP0.99
Rot. Bonds4

About 2-(6-chloro-4-ethoxypyrazolo[4,3-c]pyridin-1-yl)-N-hydroxyacetamide

2-(6-chloro-4-ethoxypyrazolo[4,3-c]pyridin-1-yl)-N-hydroxyacetamide (PubChem CID 175944893) has the molecular formula C10H11ClN4O3 and a molecular weight of 270.68 g/mol. Its IUPAC name is 2-(6-chloro-4-ethoxypyrazolo[4,3-c]pyridin-1-yl)-N-hydroxyacetamide.

Molecular Properties

Compound Name2-(6-chloro-4-ethoxypyrazolo[4,3-c]pyridin-1-yl)-N-hydroxyacetamide
PubChem CID175944893
Molecular FormulaC10H11ClN4O3
Molecular Weight270.68 g/mol
Exact Mass270.05
IUPAC Name2-(6-chloro-4-ethoxypyrazolo[4,3-c]pyridin-1-yl)-N-hydroxyacetamide
SMILESCCOc1nc(Cl)cc2c1cnn2CC(=O)NO
InChIInChI=1S/C10H11ClN4O3/c1-2-18-10-6-4-12-15(5-9(16)14-17)7(6)3-8(11)13-10/h3-4,17H,2,5H2,1H3,(H,14,16)
InChIKeyDHJUDIXZQFIJDK-UHFFFAOYSA-N
XLogP0.99
TPSA89.27 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.68
LogP ≤ 50.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(6-chloro-4-ethoxypyrazolo[4,3-c]pyridin-1-yl)-N-hydroxyacetamide?
The IUPAC name of 2-(6-chloro-4-ethoxypyrazolo[4,3-c]pyridin-1-yl)-N-hydroxyacetamide (CID 175944893) is 2-(6-chloro-4-ethoxypyrazolo[4,3-c]pyridin-1-yl)-N-hydroxyacetamide.
What is the SMILES notation for 2-(6-chloro-4-ethoxypyrazolo[4,3-c]pyridin-1-yl)-N-hydroxyacetamide?
The canonical SMILES for 2-(6-chloro-4-ethoxypyrazolo[4,3-c]pyridin-1-yl)-N-hydroxyacetamide is CCOc1nc(Cl)cc2c1cnn2CC(=O)NO.
What is the InChIKey of 2-(6-chloro-4-ethoxypyrazolo[4,3-c]pyridin-1-yl)-N-hydroxyacetamide?
The InChIKey is DHJUDIXZQFIJDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11ClN4O3/c1-2-18-10-6-4-12-15(5-9(16)14-17)7(6)3-8(11)13-10/h3-4,17H,2,5H2,1H3,(H,14,16).
What are the key properties of 2-(6-chloro-4-ethoxypyrazolo[4,3-c]pyridin-1-yl)-N-hydroxyacetamide?
2-(6-chloro-4-ethoxypyrazolo[4,3-c]pyridin-1-yl)-N-hydroxyacetamide has a molecular weight of 270.68 g/mol, XLogP of 0.99, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-chloro-4-ethoxypyrazolo[4,3-c]pyridin-1-yl)-N-hydroxyacetamide is sourced from PubChem (CID 175944893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).