1-(6-methoxy-4-phenylmethoxypyrazolo[1,5-a]pyridin-2-yl)ethanol

C17H18N2O3 — CID 153363263

IUPAC1-(6-methoxy-4-phenylmethoxypyrazolo[1,5-a]pyridin-2-yl)ethanol
SMILESCOc1cc(OCc2ccccc2)c2cc(C(C)O)nn2c1
InChIInChI=1S/C17H18N2O3/c1-12(20)15-9-16-17(8-14(21-2)10-19(16)18-15)22-11-13-6-4-3-5-7-13/h3-10,12,20H,11H2,1-2H3
InChIKeyKIMJWXMEDAAQCQ-UHFFFAOYSA-N
MW298.34 g/mol
LogP2.98
Rot. Bonds5

About 1-(6-methoxy-4-phenylmethoxypyrazolo[1,5-a]pyridin-2-yl)ethanol

1-(6-methoxy-4-phenylmethoxypyrazolo[1,5-a]pyridin-2-yl)ethanol (PubChem CID 153363263) has the molecular formula C17H18N2O3 and a molecular weight of 298.34 g/mol. Its IUPAC name is 1-(6-methoxy-4-phenylmethoxypyrazolo[1,5-a]pyridin-2-yl)ethanol.

Molecular Properties

Compound Name1-(6-methoxy-4-phenylmethoxypyrazolo[1,5-a]pyridin-2-yl)ethanol
PubChem CID153363263
Molecular FormulaC17H18N2O3
Molecular Weight298.34 g/mol
Exact Mass298.13
IUPAC Name1-(6-methoxy-4-phenylmethoxypyrazolo[1,5-a]pyridin-2-yl)ethanol
SMILESCOc1cc(OCc2ccccc2)c2cc(C(C)O)nn2c1
InChIInChI=1S/C17H18N2O3/c1-12(20)15-9-16-17(8-14(21-2)10-19(16)18-15)22-11-13-6-4-3-5-7-13/h3-10,12,20H,11H2,1-2H3
InChIKeyKIMJWXMEDAAQCQ-UHFFFAOYSA-N
XLogP2.98
TPSA55.99 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.34
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(6-methoxy-4-phenylmethoxypyrazolo[1,5-a]pyridin-2-yl)ethanol?
The IUPAC name of 1-(6-methoxy-4-phenylmethoxypyrazolo[1,5-a]pyridin-2-yl)ethanol (CID 153363263) is 1-(6-methoxy-4-phenylmethoxypyrazolo[1,5-a]pyridin-2-yl)ethanol.
What is the SMILES notation for 1-(6-methoxy-4-phenylmethoxypyrazolo[1,5-a]pyridin-2-yl)ethanol?
The canonical SMILES for 1-(6-methoxy-4-phenylmethoxypyrazolo[1,5-a]pyridin-2-yl)ethanol is COc1cc(OCc2ccccc2)c2cc(C(C)O)nn2c1.
What is the InChIKey of 1-(6-methoxy-4-phenylmethoxypyrazolo[1,5-a]pyridin-2-yl)ethanol?
The InChIKey is KIMJWXMEDAAQCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O3/c1-12(20)15-9-16-17(8-14(21-2)10-19(16)18-15)22-11-13-6-4-3-5-7-13/h3-10,12,20H,11H2,1-2H3.
What are the key properties of 1-(6-methoxy-4-phenylmethoxypyrazolo[1,5-a]pyridin-2-yl)ethanol?
1-(6-methoxy-4-phenylmethoxypyrazolo[1,5-a]pyridin-2-yl)ethanol has a molecular weight of 298.34 g/mol, XLogP of 2.98, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-methoxy-4-phenylmethoxypyrazolo[1,5-a]pyridin-2-yl)ethanol is sourced from PubChem (CID 153363263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).