3-[1-(6-methylpyrazin-2-yl)piperidin-3-yl]propanamide

C13H20N4O — CID 133469915

IUPAC3-[1-(6-methylpyrazin-2-yl)piperidin-3-yl]propanamide
SMILESCc1cncc(N2CCCC(CCC(N)=O)C2)n1
InChIInChI=1S/C13H20N4O/c1-10-7-15-8-13(16-10)17-6-2-3-11(9-17)4-5-12(14)18/h7-8,11H,2-6,9H2,1H3,(H2,14,18)
InChIKeyIPWZFGMDCNMBOT-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.27
Rot. Bonds4

About 3-[1-(6-methylpyrazin-2-yl)piperidin-3-yl]propanamide

3-[1-(6-methylpyrazin-2-yl)piperidin-3-yl]propanamide (PubChem CID 133469915) has the molecular formula C13H20N4O and a molecular weight of 248.33 g/mol. Its IUPAC name is 3-[1-(6-methylpyrazin-2-yl)piperidin-3-yl]propanamide.

Molecular Properties

Compound Name3-[1-(6-methylpyrazin-2-yl)piperidin-3-yl]propanamide
PubChem CID133469915
Molecular FormulaC13H20N4O
Molecular Weight248.33 g/mol
Exact Mass248.16
IUPAC Name3-[1-(6-methylpyrazin-2-yl)piperidin-3-yl]propanamide
SMILESCc1cncc(N2CCCC(CCC(N)=O)C2)n1
InChIInChI=1S/C13H20N4O/c1-10-7-15-8-13(16-10)17-6-2-3-11(9-17)4-5-12(14)18/h7-8,11H,2-6,9H2,1H3,(H2,14,18)
InChIKeyIPWZFGMDCNMBOT-UHFFFAOYSA-N
XLogP1.27
TPSA72.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-[1-(5-ethylpyrimidin-2-yl)piperidin-3-yl]propanamide
CID 72927654
3-[1-(6-ethyl-2-pyridin-4-ylpyrimidin-4-yl)piperidin-3-yl]propanamide
CID 133294209
N-[1-(6-methylpyrazin-2-yl)piperidin-3-yl]acetamide
CID 171327953
(3S)-1-(6-methylpyrazin-2-yl)piperidine-3-carbaldehyde
CID 42555979
3-[(3S)-1-(4-methyl-7,8-dihydro-6H-cyclopenta[g]quinazolin-2-yl)piperidin-3-yl]propanamide
CID 95205398
3-[(3R)-1-(4-methyl-7,8-dihydro-6H-cyclopenta[g]quinazolin-2-yl)piperidin-3-yl]propanamide
CID 95205397
3-[1-(2-amino-5-butyl-6-methylpyrimidin-4-yl)piperidin-3-yl]propanamide
CID 72939716
2-cyclohexyl-1-[4-(6-methylpyrazin-2-yl)piperazin-1-yl]ethanone
CID 133469560
[1-(6-methylpyrazin-2-yl)piperidin-3-yl]-thiomorpholin-4-ylmethanone
CID 155799937
2-(3-methoxypiperidin-1-yl)-6-methylpyrazine
CID 133470094
2-[(2S)-2-(6-methylpyrazin-2-yl)pyrrolidin-1-yl]acetamide
CID 95821390
(3R)-1-(6-methylpyrazin-2-yl)pyrrolidin-3-ol
CID 129412688

Frequently Asked Questions

What is the IUPAC name of 3-[1-(6-methylpyrazin-2-yl)piperidin-3-yl]propanamide?
The IUPAC name of 3-[1-(6-methylpyrazin-2-yl)piperidin-3-yl]propanamide (CID 133469915) is 3-[1-(6-methylpyrazin-2-yl)piperidin-3-yl]propanamide.
What is the SMILES notation for 3-[1-(6-methylpyrazin-2-yl)piperidin-3-yl]propanamide?
The canonical SMILES for 3-[1-(6-methylpyrazin-2-yl)piperidin-3-yl]propanamide is Cc1cncc(N2CCCC(CCC(N)=O)C2)n1.
What is the InChIKey of 3-[1-(6-methylpyrazin-2-yl)piperidin-3-yl]propanamide?
The InChIKey is IPWZFGMDCNMBOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O/c1-10-7-15-8-13(16-10)17-6-2-3-11(9-17)4-5-12(14)18/h7-8,11H,2-6,9H2,1H3,(H2,14,18).
What are the key properties of 3-[1-(6-methylpyrazin-2-yl)piperidin-3-yl]propanamide?
3-[1-(6-methylpyrazin-2-yl)piperidin-3-yl]propanamide has a molecular weight of 248.33 g/mol, XLogP of 1.27, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-(6-methylpyrazin-2-yl)piperidin-3-yl]propanamide is sourced from PubChem (CID 133469915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).