3-[6-[1-(pyrazine-2-carbonyl)piperidin-4-yl]-2-pyridinyl]propanamide

C18H21N5O2 — CID 95820724

IUPAC3-[6-[1-(pyrazine-2-carbonyl)piperidin-4-yl]-2-pyridinyl]propanamide
SMILESNC(=O)CCc1cccc(C2CCN(C(=O)c3cnccn3)CC2)n1
InChIInChI=1S/C18H21N5O2/c19-17(24)5-4-14-2-1-3-15(22-14)13-6-10-23(11-7-13)18(25)16-12-20-8-9-21-16/h1-3,8-9,12-13H,4-7,10-11H2,(H2,19,24)
InChIKeyHICHGJUMZNTSGD-UHFFFAOYSA-N
MW339.40 g/mol
LogP1.31
Rot. Bonds5

About 3-[6-[1-(pyrazine-2-carbonyl)piperidin-4-yl]-2-pyridinyl]propanamide

3-[6-[1-(pyrazine-2-carbonyl)piperidin-4-yl]-2-pyridinyl]propanamide (PubChem CID 95820724) has the molecular formula C18H21N5O2 and a molecular weight of 339.40 g/mol. Its IUPAC name is 3-[6-[1-(pyrazine-2-carbonyl)piperidin-4-yl]-2-pyridinyl]propanamide.

Molecular Properties

Compound Name3-[6-[1-(pyrazine-2-carbonyl)piperidin-4-yl]-2-pyridinyl]propanamide
PubChem CID95820724
Molecular FormulaC18H21N5O2
Molecular Weight339.40 g/mol
Exact Mass339.17
IUPAC Name3-[6-[1-(pyrazine-2-carbonyl)piperidin-4-yl]-2-pyridinyl]propanamide
SMILESNC(=O)CCc1cccc(C2CCN(C(=O)c3cnccn3)CC2)n1
InChIInChI=1S/C18H21N5O2/c19-17(24)5-4-14-2-1-3-15(22-14)13-6-10-23(11-7-13)18(25)16-12-20-8-9-21-16/h1-3,8-9,12-13H,4-7,10-11H2,(H2,19,24)
InChIKeyHICHGJUMZNTSGD-UHFFFAOYSA-N
XLogP1.31
TPSA102.07 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.40
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[4-[6-[(2-methylphenyl)methyl]-2-pyridinyl]piperidin-1-yl]-pyrazin-2-ylmethanone
CID 95809553
3-[6-[1-(oxane-4-carbonyl)piperidin-4-yl]-2-pyridinyl]propanamide
CID 95820768
3-[6-[1-(pyrazine-2-carbonyl)pyrrolidin-2-yl]-2-pyridinyl]propanoic acid
CID 110258258
[4-[6-(2-methylphenyl)pyrazin-2-yl]piperidin-1-yl]-pyrazin-2-ylmethanone
CID 95819757
3-[6-[(3R)-1-(oxane-4-carbonyl)piperidin-3-yl]-2-pyridinyl]propanamide
CID 95820769
[(3R)-3-[6-[(3-methoxyphenyl)methyl]-2-pyridinyl]piperidin-1-yl]-pyrazin-2-ylmethanone
CID 95809563
pyrazin-2-yl-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]methanone
CID 35897297
3-[6-[(3S)-1-pyrazin-2-ylpiperidin-3-yl]-2-pyridinyl]propanoic acid
CID 95827209
[4-(2-hydroxyethyl)piperidin-1-yl]-pyrazin-2-ylmethanone
CID 121200756
[4-[6-[(2-fluorophenyl)methyl]-2-pyridinyl]piperidin-1-yl]-pyridin-3-ylmethanone
CID 95809453
[(3S)-3-[6-(methylamino)-2-pyridinyl]piperidin-1-yl]-pyrazin-2-ylmethanone
CID 95824147
[4-(2-phenoxyethyl)piperidin-1-yl]-pyrazin-2-ylmethanone
CID 53150710

Frequently Asked Questions

What is the IUPAC name of 3-[6-[1-(pyrazine-2-carbonyl)piperidin-4-yl]-2-pyridinyl]propanamide?
The IUPAC name of 3-[6-[1-(pyrazine-2-carbonyl)piperidin-4-yl]-2-pyridinyl]propanamide (CID 95820724) is 3-[6-[1-(pyrazine-2-carbonyl)piperidin-4-yl]-2-pyridinyl]propanamide.
What is the SMILES notation for 3-[6-[1-(pyrazine-2-carbonyl)piperidin-4-yl]-2-pyridinyl]propanamide?
The canonical SMILES for 3-[6-[1-(pyrazine-2-carbonyl)piperidin-4-yl]-2-pyridinyl]propanamide is NC(=O)CCc1cccc(C2CCN(C(=O)c3cnccn3)CC2)n1.
What is the InChIKey of 3-[6-[1-(pyrazine-2-carbonyl)piperidin-4-yl]-2-pyridinyl]propanamide?
The InChIKey is HICHGJUMZNTSGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N5O2/c19-17(24)5-4-14-2-1-3-15(22-14)13-6-10-23(11-7-13)18(25)16-12-20-8-9-21-16/h1-3,8-9,12-13H,4-7,10-11H2,(H2,19,24).
What are the key properties of 3-[6-[1-(pyrazine-2-carbonyl)piperidin-4-yl]-2-pyridinyl]propanamide?
3-[6-[1-(pyrazine-2-carbonyl)piperidin-4-yl]-2-pyridinyl]propanamide has a molecular weight of 339.40 g/mol, XLogP of 1.31, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[6-[1-(pyrazine-2-carbonyl)piperidin-4-yl]-2-pyridinyl]propanamide is sourced from PubChem (CID 95820724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).