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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Related Compounds

4-[[4-(5-pyrrolidin-1-ylpyrazin-2-yl)phenyl]methyl]piperazine-1-carbaldehyde
CID 146252780
1-(5-phenylpyrazin-2-yl)azepane
CID 166601448
4-[[6-(4-pyrrolidin-1-ylphenyl)pyridazin-3-yl]methyl]-1,4-oxazepane
CID 146252717
2-[3-methyl-4-[(4-methylpiperazin-1-yl)methyl]phenyl]-5-pyrrolidin-1-ylpyrazine
CID 146252701
N,4-dimethyl-3-[6-(morpholin-4-ylmethyl)-3-pyridinyl]aniline
CID 143943044
lithium 6-(morpholin-4-ylmethyl)pyridine-3-carboxylate
CID 118364714
2-[4-[(3,5-dimethylpiperazin-1-yl)methyl]phenyl]-5-pyrrolidin-1-ylpyrazine
CID 146252770
4-[[5-[4-[3-(1,3-oxazol-5-yl)phenyl]naphthalen-1-yl]-2-pyridinyl]methyl]morpholine
CID 91211472
4-[(5-ethylsulfanyl-2-pyridinyl)methyl]morpholine
CID 144686812
1-(3-hydroxy-5,6,7,8-tetrahydronaphthalen-2-yl)-3-[4-[6-(morpholin-4-ylmethyl)-3-pyridinyl]naphthalen-1-yl]urea
CID 10207644
N-(2-morpholin-4-ylethyl)-5-pyrrolidin-1-ylpyrazine-2-carboxamide
CID 109273701
methane;2-(4-piperidin-1-ylphenyl)-5-(4-propan-2-ylpiperazin-1-yl)pyrazine
CID 158847619

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).