4-[[1-(3,6-dimethylpyrazin-2-yl)piperidin-4-yl]methyl]-2,6-dimethylmorpholine

C18H30N4O — CID 133469851

IUPAC4-[[1-(3,6-dimethylpyrazin-2-yl)piperidin-4-yl]methyl]-2,6-dimethylmorpholine
SMILESCc1cnc(C)c(N2CCC(CN3CC(C)OC(C)C3)CC2)n1
InChIInChI=1S/C18H30N4O/c1-13-9-19-16(4)18(20-13)22-7-5-17(6-8-22)12-21-10-14(2)23-15(3)11-21/h9,14-15,17H,5-8,10-12H2,1-4H3
InChIKeyRDWXLWAGWWPSRX-UHFFFAOYSA-N
MW318.47 g/mol
LogP2.42
Rot. Bonds3

About 4-[[1-(3,6-dimethylpyrazin-2-yl)piperidin-4-yl]methyl]-2,6-dimethylmorpholine

4-[[1-(3,6-dimethylpyrazin-2-yl)piperidin-4-yl]methyl]-2,6-dimethylmorpholine (PubChem CID 133469851) has the molecular formula C18H30N4O and a molecular weight of 318.47 g/mol. Its IUPAC name is 4-[[1-(3,6-dimethylpyrazin-2-yl)piperidin-4-yl]methyl]-2,6-dimethylmorpholine.

Molecular Properties

Compound Name4-[[1-(3,6-dimethylpyrazin-2-yl)piperidin-4-yl]methyl]-2,6-dimethylmorpholine
PubChem CID133469851
Molecular FormulaC18H30N4O
Molecular Weight318.47 g/mol
Exact Mass318.24
IUPAC Name4-[[1-(3,6-dimethylpyrazin-2-yl)piperidin-4-yl]methyl]-2,6-dimethylmorpholine
SMILESCc1cnc(C)c(N2CCC(CN3CC(C)OC(C)C3)CC2)n1
InChIInChI=1S/C18H30N4O/c1-13-9-19-16(4)18(20-13)22-7-5-17(6-8-22)12-21-10-14(2)23-15(3)11-21/h9,14-15,17H,5-8,10-12H2,1-4H3
InChIKeyRDWXLWAGWWPSRX-UHFFFAOYSA-N
XLogP2.42
TPSA41.49 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.47
LogP ≤ 52.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

3-[3-(bromomethyl)pyrrolidin-1-yl]-2,5-dimethylpyrazine
CID 80680091
4-[4-[[(2R,6R)-2,6-dimethylmorpholin-4-yl]methyl]piperidin-1-yl]furo[3,2-c]pyridine
CID 97120477
4-[[1-(6-chloro-2-ethyl-5-methylpyrimidin-4-yl)piperidin-4-yl]methyl]-2,6-dimethylmorpholine
CID 133447912
4-[4-[(2,6-dimethylmorpholin-4-yl)methyl]piperidin-1-yl]-6-pyrazol-1-ylpyrimidin-5-amine
CID 133447844
2-[1-(3,6-dimethylpyrazin-2-yl)pyrrolidin-3-yl]acetamide
CID 126808174
3-(3-bromo-4-methylpiperidin-1-yl)-2,5-dimethylpyrazine
CID 102961228
1-(3,6-dimethylpyrazin-2-yl)piperidine-4-carbaldehyde
CID 65419285
2-[4-[(2,6-dimethylmorpholin-4-yl)methyl]piperidin-1-yl]aniline
CID 156796662
2,5-dimethyl-3-[4-[(4-methyl-1,2,4-triazol-3-yl)methyl]piperidin-1-yl]pyrazine
CID 138008520
3-[4-(1-chloroethyl)piperidin-1-yl]-2,5-dimethylpyrazine
CID 106838567
2,5-dimethyl-3-[(3S)-3-methylpiperazin-1-yl]pyrazine
CID 94450675
2,5-dimethyl-3-[(3R)-3-methylpiperazin-1-yl]pyrazine
CID 94450674

Frequently Asked Questions

What is the IUPAC name of 4-[[1-(3,6-dimethylpyrazin-2-yl)piperidin-4-yl]methyl]-2,6-dimethylmorpholine?
The IUPAC name of 4-[[1-(3,6-dimethylpyrazin-2-yl)piperidin-4-yl]methyl]-2,6-dimethylmorpholine (CID 133469851) is 4-[[1-(3,6-dimethylpyrazin-2-yl)piperidin-4-yl]methyl]-2,6-dimethylmorpholine.
What is the SMILES notation for 4-[[1-(3,6-dimethylpyrazin-2-yl)piperidin-4-yl]methyl]-2,6-dimethylmorpholine?
The canonical SMILES for 4-[[1-(3,6-dimethylpyrazin-2-yl)piperidin-4-yl]methyl]-2,6-dimethylmorpholine is Cc1cnc(C)c(N2CCC(CN3CC(C)OC(C)C3)CC2)n1.
What is the InChIKey of 4-[[1-(3,6-dimethylpyrazin-2-yl)piperidin-4-yl]methyl]-2,6-dimethylmorpholine?
The InChIKey is RDWXLWAGWWPSRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N4O/c1-13-9-19-16(4)18(20-13)22-7-5-17(6-8-22)12-21-10-14(2)23-15(3)11-21/h9,14-15,17H,5-8,10-12H2,1-4H3.
What are the key properties of 4-[[1-(3,6-dimethylpyrazin-2-yl)piperidin-4-yl]methyl]-2,6-dimethylmorpholine?
4-[[1-(3,6-dimethylpyrazin-2-yl)piperidin-4-yl]methyl]-2,6-dimethylmorpholine has a molecular weight of 318.47 g/mol, XLogP of 2.42, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[1-(3,6-dimethylpyrazin-2-yl)piperidin-4-yl]methyl]-2,6-dimethylmorpholine is sourced from PubChem (CID 133469851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).