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

C11H14ClN3O2 — CID 177381484

IUPAC3-(6-chloro-4-ethoxypyrazolo[4,3-c]pyridin-2-yl)propan-1-ol
SMILESCCOc1nc(Cl)cc2nn(CCCO)cc12
InChIInChI=1S/C11H14ClN3O2/c1-2-17-11-8-7-15(4-3-5-16)14-9(8)6-10(12)13-11/h6-7,16H,2-5H2,1H3
InChIKeyRALDCISJRJTGEI-UHFFFAOYSA-N
MW255.70 g/mol
LogP1.87
Rot. Bonds5

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

3-(6-chloro-4-ethoxypyrazolo[4,3-c]pyridin-2-yl)propan-1-ol (PubChem CID 177381484) has the molecular formula C11H14ClN3O2 and a molecular weight of 255.70 g/mol. Its IUPAC name is 3-(6-chloro-4-ethoxypyrazolo[4,3-c]pyridin-2-yl)propan-1-ol.

Molecular Properties

Compound Name3-(6-chloro-4-ethoxypyrazolo[4,3-c]pyridin-2-yl)propan-1-ol
PubChem CID177381484
Molecular FormulaC11H14ClN3O2
Molecular Weight255.70 g/mol
Exact Mass255.08
IUPAC Name3-(6-chloro-4-ethoxypyrazolo[4,3-c]pyridin-2-yl)propan-1-ol
SMILESCCOc1nc(Cl)cc2nn(CCCO)cc12
InChIInChI=1S/C11H14ClN3O2/c1-2-17-11-8-7-15(4-3-5-16)14-9(8)6-10(12)13-11/h6-7,16H,2-5H2,1H3
InChIKeyRALDCISJRJTGEI-UHFFFAOYSA-N
XLogP1.87
TPSA60.17 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.70
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

4-Ethoxy-3-methyl-1h-pyrazolo[4,3-c]pyridine
CID 46912641
3-methyl-4-propan-2-yloxy-2H-pyrazolo[4,3-c]pyridine
CID 59618947
3-chloro-2-{[1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]oxy}-5-(trifluoromethyl)pyridine
CID 2767282
3-chloro-2-{[1-methyl-5-(trifluoromethyl)-1H-pyrazol-3-yl]oxy}-5-(trifluoromethyl)pyridine
CID 2768929
6-Chloro-4-ethoxy-2-(oxan-4-yl)pyrazolo[4,3-c]pyridine
CID 175944886
4-(6-Chloro-3-cyclopropyl-4-ethoxypyrazolo[4,3-c]pyridin-1-yl)butanoic acid
CID 175944887
2-(6-Chloro-4-ethoxypyrazolo[4,3-c]pyridin-1-yl)acetic acid
CID 175944889
6-Chloro-4-ethoxy-1-(oxan-4-yl)pyrazolo[4,3-c]pyridine
CID 175944890
2-(6-chloro-4-ethoxypyrazolo[4,3-c]pyridin-1-yl)-N-hydroxyacetamide
CID 175944893
4-Ethoxy-1-(oxan-4-yl)pyrazolo[4,5-c]pyridine-6-carbonitrile
CID 175944895
4-(6-Chloro-4-ethoxy-3-pyridin-4-ylpyrazolo[4,3-c]pyridin-1-yl)butanoic acid
CID 175944896
6-Chloro-1-(oxan-4-yl)-4-propan-2-yloxypyrazolo[4,3-c]pyridine
CID 175944897

Frequently Asked Questions

What is the IUPAC name of 3-(6-chloro-4-ethoxypyrazolo[4,3-c]pyridin-2-yl)propan-1-ol?
The IUPAC name of 3-(6-chloro-4-ethoxypyrazolo[4,3-c]pyridin-2-yl)propan-1-ol (CID 177381484) is 3-(6-chloro-4-ethoxypyrazolo[4,3-c]pyridin-2-yl)propan-1-ol.
What is the SMILES notation for 3-(6-chloro-4-ethoxypyrazolo[4,3-c]pyridin-2-yl)propan-1-ol?
The canonical SMILES for 3-(6-chloro-4-ethoxypyrazolo[4,3-c]pyridin-2-yl)propan-1-ol is CCOc1nc(Cl)cc2nn(CCCO)cc12.
What is the InChIKey of 3-(6-chloro-4-ethoxypyrazolo[4,3-c]pyridin-2-yl)propan-1-ol?
The InChIKey is RALDCISJRJTGEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14ClN3O2/c1-2-17-11-8-7-15(4-3-5-16)14-9(8)6-10(12)13-11/h6-7,16H,2-5H2,1H3.
What are the key properties of 3-(6-chloro-4-ethoxypyrazolo[4,3-c]pyridin-2-yl)propan-1-ol?
3-(6-chloro-4-ethoxypyrazolo[4,3-c]pyridin-2-yl)propan-1-ol has a molecular weight of 255.70 g/mol, XLogP of 1.87, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6-chloro-4-ethoxypyrazolo[4,3-c]pyridin-2-yl)propan-1-ol is sourced from PubChem (CID 177381484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).