4-(oxan-4-yloxy)-3-(1H-pyrazol-5-yl)-1H-pyrazolo[4,3-c]pyridine

C14H15N5O2 — CID 66828963

IUPAC4-(oxan-4-yloxy)-3-(1H-pyrazol-5-yl)-1H-pyrazolo[4,3-c]pyridine
SMILESc1cc(-c2n[nH]c3ccnc(OC4CCOCC4)c23)[nH]n1
InChIInChI=1S/C14H15N5O2/c1-5-15-14(21-9-3-7-20-8-4-9)12-10(1)18-19-13(12)11-2-6-16-17-11/h1-2,5-6,9H,3-4,7-8H2,(H,16,17)(H,18,19)
InChIKeyBOVWDSLGXDQDJA-UHFFFAOYSA-N
MW285.31 g/mol
LogP1.91
Rot. Bonds3

About 4-(oxan-4-yloxy)-3-(1H-pyrazol-5-yl)-1H-pyrazolo[4,3-c]pyridine

4-(oxan-4-yloxy)-3-(1H-pyrazol-5-yl)-1H-pyrazolo[4,3-c]pyridine (PubChem CID 66828963) has the molecular formula C14H15N5O2 and a molecular weight of 285.31 g/mol. Its IUPAC name is 4-(oxan-4-yloxy)-3-(1H-pyrazol-5-yl)-1H-pyrazolo[4,3-c]pyridine.

Molecular Properties

Compound Name4-(oxan-4-yloxy)-3-(1H-pyrazol-5-yl)-1H-pyrazolo[4,3-c]pyridine
PubChem CID66828963
Molecular FormulaC14H15N5O2
Molecular Weight285.31 g/mol
Exact Mass285.12
IUPAC Name4-(oxan-4-yloxy)-3-(1H-pyrazol-5-yl)-1H-pyrazolo[4,3-c]pyridine
SMILESc1cc(-c2n[nH]c3ccnc(OC4CCOCC4)c23)[nH]n1
InChIInChI=1S/C14H15N5O2/c1-5-15-14(21-9-3-7-20-8-4-9)12-10(1)18-19-13(12)11-2-6-16-17-11/h1-2,5-6,9H,3-4,7-8H2,(H,16,17)(H,18,19)
InChIKeyBOVWDSLGXDQDJA-UHFFFAOYSA-N
XLogP1.91
TPSA88.71 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.31
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

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CID 46898099
CID 46898099
CID 46912641
CID 46912641
CID 59618824
CID 59618824
CID 59618947
CID 59618947
CID 59618953
CID 59618953
CID 59619022
CID 59619022
CID 59619145
CID 59619145
CID 66827038
CID 66827038
CID 66829086
CID 66829086
CID 66829097
CID 66829097

Frequently Asked Questions

What is the IUPAC name of 4-(oxan-4-yloxy)-3-(1H-pyrazol-5-yl)-1H-pyrazolo[4,3-c]pyridine?
The IUPAC name of 4-(oxan-4-yloxy)-3-(1H-pyrazol-5-yl)-1H-pyrazolo[4,3-c]pyridine (CID 66828963) is 4-(oxan-4-yloxy)-3-(1H-pyrazol-5-yl)-1H-pyrazolo[4,3-c]pyridine.
What is the SMILES notation for 4-(oxan-4-yloxy)-3-(1H-pyrazol-5-yl)-1H-pyrazolo[4,3-c]pyridine?
The canonical SMILES for 4-(oxan-4-yloxy)-3-(1H-pyrazol-5-yl)-1H-pyrazolo[4,3-c]pyridine is c1cc(-c2n[nH]c3ccnc(OC4CCOCC4)c23)[nH]n1.
What is the InChIKey of 4-(oxan-4-yloxy)-3-(1H-pyrazol-5-yl)-1H-pyrazolo[4,3-c]pyridine?
The InChIKey is BOVWDSLGXDQDJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N5O2/c1-5-15-14(21-9-3-7-20-8-4-9)12-10(1)18-19-13(12)11-2-6-16-17-11/h1-2,5-6,9H,3-4,7-8H2,(H,16,17)(H,18,19).
What are the key properties of 4-(oxan-4-yloxy)-3-(1H-pyrazol-5-yl)-1H-pyrazolo[4,3-c]pyridine?
4-(oxan-4-yloxy)-3-(1H-pyrazol-5-yl)-1H-pyrazolo[4,3-c]pyridine has a molecular weight of 285.31 g/mol, XLogP of 1.91, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(oxan-4-yloxy)-3-(1H-pyrazol-5-yl)-1H-pyrazolo[4,3-c]pyridine is sourced from PubChem (CID 66828963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).