4-[4-(4-methoxy-1H-pyrazolo[4,3-c]pyridin-3-yl)-2-pyridinyl]morpholine

C16H17N5O2 — CID 66829077

IUPAC4-[4-(4-methoxy-1H-pyrazolo[4,3-c]pyridin-3-yl)-2-pyridinyl]morpholine
SMILESCOc1nccc2[nH]nc(-c3ccnc(N4CCOCC4)c3)c12
InChIInChI=1S/C16H17N5O2/c1-22-16-14-12(3-5-18-16)19-20-15(14)11-2-4-17-13(10-11)21-6-8-23-9-7-21/h2-5,10H,6-9H2,1H3,(H,19,20)
InChIKeyJRONHPPZBYOMIU-UHFFFAOYSA-N
MW311.35 g/mol
LogP1.87
Rot. Bonds3

About 4-[4-(4-methoxy-1H-pyrazolo[4,3-c]pyridin-3-yl)-2-pyridinyl]morpholine

4-[4-(4-methoxy-1H-pyrazolo[4,3-c]pyridin-3-yl)-2-pyridinyl]morpholine (PubChem CID 66829077) has the molecular formula C16H17N5O2 and a molecular weight of 311.35 g/mol. Its IUPAC name is 4-[4-(4-methoxy-1H-pyrazolo[4,3-c]pyridin-3-yl)-2-pyridinyl]morpholine.

Molecular Properties

Compound Name4-[4-(4-methoxy-1H-pyrazolo[4,3-c]pyridin-3-yl)-2-pyridinyl]morpholine
PubChem CID66829077
Molecular FormulaC16H17N5O2
Molecular Weight311.35 g/mol
Exact Mass311.14
IUPAC Name4-[4-(4-methoxy-1H-pyrazolo[4,3-c]pyridin-3-yl)-2-pyridinyl]morpholine
SMILESCOc1nccc2[nH]nc(-c3ccnc(N4CCOCC4)c3)c12
InChIInChI=1S/C16H17N5O2/c1-22-16-14-12(3-5-18-16)19-20-15(14)11-2-4-17-13(10-11)21-6-8-23-9-7-21/h2-5,10H,6-9H2,1H3,(H,19,20)
InChIKeyJRONHPPZBYOMIU-UHFFFAOYSA-N
XLogP1.87
TPSA76.16 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.35
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-[4-(4-methoxy-1H-pyrazolo[4,3-c]pyridin-3-yl)-2-pyridinyl]morpholine?
The IUPAC name of 4-[4-(4-methoxy-1H-pyrazolo[4,3-c]pyridin-3-yl)-2-pyridinyl]morpholine (CID 66829077) is 4-[4-(4-methoxy-1H-pyrazolo[4,3-c]pyridin-3-yl)-2-pyridinyl]morpholine.
What is the SMILES notation for 4-[4-(4-methoxy-1H-pyrazolo[4,3-c]pyridin-3-yl)-2-pyridinyl]morpholine?
The canonical SMILES for 4-[4-(4-methoxy-1H-pyrazolo[4,3-c]pyridin-3-yl)-2-pyridinyl]morpholine is COc1nccc2[nH]nc(-c3ccnc(N4CCOCC4)c3)c12.
What is the InChIKey of 4-[4-(4-methoxy-1H-pyrazolo[4,3-c]pyridin-3-yl)-2-pyridinyl]morpholine?
The InChIKey is JRONHPPZBYOMIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N5O2/c1-22-16-14-12(3-5-18-16)19-20-15(14)11-2-4-17-13(10-11)21-6-8-23-9-7-21/h2-5,10H,6-9H2,1H3,(H,19,20).
What are the key properties of 4-[4-(4-methoxy-1H-pyrazolo[4,3-c]pyridin-3-yl)-2-pyridinyl]morpholine?
4-[4-(4-methoxy-1H-pyrazolo[4,3-c]pyridin-3-yl)-2-pyridinyl]morpholine has a molecular weight of 311.35 g/mol, XLogP of 1.87, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(4-methoxy-1H-pyrazolo[4,3-c]pyridin-3-yl)-2-pyridinyl]morpholine is sourced from PubChem (CID 66829077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).