4-[[5-(5-pyrrolidin-1-ylpyrazin-2-yl)-2-pyridinyl]methyl]morpholine

C18H23N5O — CID 146252768

IUPAC4-[[5-(5-pyrrolidin-1-ylpyrazin-2-yl)-2-pyridinyl]methyl]morpholine
SMILESc1cc(CN2CCOCC2)ncc1-c1cnc(N2CCCC2)cn1
InChIInChI=1S/C18H23N5O/c1-2-6-23(5-1)18-13-20-17(12-21-18)15-3-4-16(19-11-15)14-22-7-9-24-10-8-22/h3-4,11-13H,1-2,5-10,14H2
InChIKeySJKXOOYHMNMOSI-UHFFFAOYSA-N
MW325.42 g/mol
LogP1.97
Rot. Bonds4

About 4-[[5-(5-pyrrolidin-1-ylpyrazin-2-yl)-2-pyridinyl]methyl]morpholine

4-[[5-(5-pyrrolidin-1-ylpyrazin-2-yl)-2-pyridinyl]methyl]morpholine (PubChem CID 146252768) has the molecular formula C18H23N5O and a molecular weight of 325.42 g/mol. Its IUPAC name is 4-[[5-(5-pyrrolidin-1-ylpyrazin-2-yl)-2-pyridinyl]methyl]morpholine.

Molecular Properties

Compound Name4-[[5-(5-pyrrolidin-1-ylpyrazin-2-yl)-2-pyridinyl]methyl]morpholine
PubChem CID146252768
Molecular FormulaC18H23N5O
Molecular Weight325.42 g/mol
Exact Mass325.19
IUPAC Name4-[[5-(5-pyrrolidin-1-ylpyrazin-2-yl)-2-pyridinyl]methyl]morpholine
SMILESc1cc(CN2CCOCC2)ncc1-c1cnc(N2CCCC2)cn1
InChIInChI=1S/C18H23N5O/c1-2-6-23(5-1)18-13-20-17(12-21-18)15-3-4-16(19-11-15)14-22-7-9-24-10-8-22/h3-4,11-13H,1-2,5-10,14H2
InChIKeySJKXOOYHMNMOSI-UHFFFAOYSA-N
XLogP1.97
TPSA54.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.42
LogP ≤ 51.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-[[5-(5-pyrrolidin-1-ylpyrazin-2-yl)-2-pyridinyl]methyl]morpholine?
The IUPAC name of 4-[[5-(5-pyrrolidin-1-ylpyrazin-2-yl)-2-pyridinyl]methyl]morpholine (CID 146252768) is 4-[[5-(5-pyrrolidin-1-ylpyrazin-2-yl)-2-pyridinyl]methyl]morpholine.
What is the SMILES notation for 4-[[5-(5-pyrrolidin-1-ylpyrazin-2-yl)-2-pyridinyl]methyl]morpholine?
The canonical SMILES for 4-[[5-(5-pyrrolidin-1-ylpyrazin-2-yl)-2-pyridinyl]methyl]morpholine is c1cc(CN2CCOCC2)ncc1-c1cnc(N2CCCC2)cn1.
What is the InChIKey of 4-[[5-(5-pyrrolidin-1-ylpyrazin-2-yl)-2-pyridinyl]methyl]morpholine?
The InChIKey is SJKXOOYHMNMOSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N5O/c1-2-6-23(5-1)18-13-20-17(12-21-18)15-3-4-16(19-11-15)14-22-7-9-24-10-8-22/h3-4,11-13H,1-2,5-10,14H2.
What are the key properties of 4-[[5-(5-pyrrolidin-1-ylpyrazin-2-yl)-2-pyridinyl]methyl]morpholine?
4-[[5-(5-pyrrolidin-1-ylpyrazin-2-yl)-2-pyridinyl]methyl]morpholine has a molecular weight of 325.42 g/mol, XLogP of 1.97, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[5-(5-pyrrolidin-1-ylpyrazin-2-yl)-2-pyridinyl]methyl]morpholine is sourced from PubChem (CID 146252768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).