1-[3-[3-[(2-methyl-3-pyridinyl)oxy]pyrazin-2-yl]piperidin-1-yl]ethanone

C17H20N4O2 — CID 110256201

IUPAC1-[3-[3-[(2-methyl-3-pyridinyl)oxy]pyrazin-2-yl]piperidin-1-yl]ethanone
SMILESCC(=O)N1CCCC(c2nccnc2Oc2cccnc2C)C1
InChIInChI=1S/C17H20N4O2/c1-12-15(6-3-7-18-12)23-17-16(19-8-9-20-17)14-5-4-10-21(11-14)13(2)22/h3,6-9,14H,4-5,10-11H2,1-2H3
InChIKeyFTILZJWFKMYCSZ-UHFFFAOYSA-N
MW312.37 g/mol
LogP2.70
Rot. Bonds3

About 1-[3-[3-[(2-methyl-3-pyridinyl)oxy]pyrazin-2-yl]piperidin-1-yl]ethanone

1-[3-[3-[(2-methyl-3-pyridinyl)oxy]pyrazin-2-yl]piperidin-1-yl]ethanone (PubChem CID 110256201) has the molecular formula C17H20N4O2 and a molecular weight of 312.37 g/mol. Its IUPAC name is 1-[3-[3-[(2-methyl-3-pyridinyl)oxy]pyrazin-2-yl]piperidin-1-yl]ethanone.

Molecular Properties

Compound Name1-[3-[3-[(2-methyl-3-pyridinyl)oxy]pyrazin-2-yl]piperidin-1-yl]ethanone
PubChem CID110256201
Molecular FormulaC17H20N4O2
Molecular Weight312.37 g/mol
Exact Mass312.16
IUPAC Name1-[3-[3-[(2-methyl-3-pyridinyl)oxy]pyrazin-2-yl]piperidin-1-yl]ethanone
SMILESCC(=O)N1CCCC(c2nccnc2Oc2cccnc2C)C1
InChIInChI=1S/C17H20N4O2/c1-12-15(6-3-7-18-12)23-17-16(19-8-9-20-17)14-5-4-10-21(11-14)13(2)22/h3,6-9,14H,4-5,10-11H2,1-2H3
InChIKeyFTILZJWFKMYCSZ-UHFFFAOYSA-N
XLogP2.70
TPSA68.21 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.37
LogP ≤ 52.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

3-methyl-1-[(3S)-3-[3-[(2-methyl-3-pyridinyl)oxy]pyrazin-2-yl]piperidin-1-yl]butan-1-one
CID 95843540
1-[(3R)-3-[3-(2-methoxyphenoxy)pyrazin-2-yl]piperidin-1-yl]ethanone
CID 95821902
2-[(2-methyl-3-pyridinyl)oxy]-3-(1-pyrimidin-2-ylpiperidin-3-yl)pyrazine
CID 110256460
2-[(2-methyl-3-pyridinyl)oxy]-3-[(3S)-1-pyrimidin-2-ylpiperidin-3-yl]pyrazine
CID 95822678
1-[(3R)-3-[3-(4-fluorophenoxy)pyrazin-2-yl]piperidin-1-yl]ethanone
CID 95821906
1-[(3S)-3-[3-(3-methylphenoxy)pyrazin-2-yl]piperidin-1-yl]ethanone
CID 95821922
2-[(2-methyl-3-pyridinyl)oxy]-3-[(3R)-1-(pyridin-2-ylmethyl)piperidin-3-yl]pyrazine
CID 95843459
(2,4-dimethyl-1,3-oxazol-5-yl)-[4-[3-[(2-methyl-3-pyridinyl)oxy]pyrazin-2-yl]piperidin-1-yl]methanone
CID 95843926
2-(methylamino)-1-[(3R)-3-[3-(2-methylphenoxy)pyrazin-2-yl]piperidin-1-yl]ethanone
CID 95823499
2-chloro-1-[3-[3-(2-chlorophenoxy)pyrazin-2-yl]piperidin-1-yl]ethanone
CID 175658243
2-amino-1-[(3R)-3-[3-(2-methoxyphenoxy)pyrazin-2-yl]piperidin-1-yl]-2-methylpropan-1-one
CID 95823252
[3-[3-(2-methylphenoxy)pyrazin-2-yl]piperidin-1-yl]-(1-methylpyrazol-4-yl)methanone
CID 110256626

Frequently Asked Questions

What is the IUPAC name of 1-[3-[3-[(2-methyl-3-pyridinyl)oxy]pyrazin-2-yl]piperidin-1-yl]ethanone?
The IUPAC name of 1-[3-[3-[(2-methyl-3-pyridinyl)oxy]pyrazin-2-yl]piperidin-1-yl]ethanone (CID 110256201) is 1-[3-[3-[(2-methyl-3-pyridinyl)oxy]pyrazin-2-yl]piperidin-1-yl]ethanone.
What is the SMILES notation for 1-[3-[3-[(2-methyl-3-pyridinyl)oxy]pyrazin-2-yl]piperidin-1-yl]ethanone?
The canonical SMILES for 1-[3-[3-[(2-methyl-3-pyridinyl)oxy]pyrazin-2-yl]piperidin-1-yl]ethanone is CC(=O)N1CCCC(c2nccnc2Oc2cccnc2C)C1.
What is the InChIKey of 1-[3-[3-[(2-methyl-3-pyridinyl)oxy]pyrazin-2-yl]piperidin-1-yl]ethanone?
The InChIKey is FTILZJWFKMYCSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4O2/c1-12-15(6-3-7-18-12)23-17-16(19-8-9-20-17)14-5-4-10-21(11-14)13(2)22/h3,6-9,14H,4-5,10-11H2,1-2H3.
What are the key properties of 1-[3-[3-[(2-methyl-3-pyridinyl)oxy]pyrazin-2-yl]piperidin-1-yl]ethanone?
1-[3-[3-[(2-methyl-3-pyridinyl)oxy]pyrazin-2-yl]piperidin-1-yl]ethanone has a molecular weight of 312.37 g/mol, XLogP of 2.70, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-[3-[(2-methyl-3-pyridinyl)oxy]pyrazin-2-yl]piperidin-1-yl]ethanone is sourced from PubChem (CID 110256201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).