6-[4-(6-methylpyrazin-2-yl)oxypiperidin-1-yl]pyridine-3-carbonitrile

C16H17N5O — CID 171701933

IUPAC6-[4-(6-methylpyrazin-2-yl)oxypiperidin-1-yl]pyridine-3-carbonitrile
SMILESCc1cncc(OC2CCN(c3ccc(C#N)cn3)CC2)n1
InChIInChI=1S/C16H17N5O/c1-12-9-18-11-16(20-12)22-14-4-6-21(7-5-14)15-3-2-13(8-17)10-19-15/h2-3,9-11,14H,4-7H2,1H3
InChIKeyZBBSRHKUSLMHPA-UHFFFAOYSA-N
MW295.35 g/mol
LogP2.10
Rot. Bonds3

About 6-[4-(6-methylpyrazin-2-yl)oxypiperidin-1-yl]pyridine-3-carbonitrile

6-[4-(6-methylpyrazin-2-yl)oxypiperidin-1-yl]pyridine-3-carbonitrile (PubChem CID 171701933) has the molecular formula C16H17N5O and a molecular weight of 295.35 g/mol. Its IUPAC name is 6-[4-(6-methylpyrazin-2-yl)oxypiperidin-1-yl]pyridine-3-carbonitrile.

Molecular Properties

Compound Name6-[4-(6-methylpyrazin-2-yl)oxypiperidin-1-yl]pyridine-3-carbonitrile
PubChem CID171701933
Molecular FormulaC16H17N5O
Molecular Weight295.35 g/mol
Exact Mass295.14
IUPAC Name6-[4-(6-methylpyrazin-2-yl)oxypiperidin-1-yl]pyridine-3-carbonitrile
SMILESCc1cncc(OC2CCN(c3ccc(C#N)cn3)CC2)n1
InChIInChI=1S/C16H17N5O/c1-12-9-18-11-16(20-12)22-14-4-6-21(7-5-14)15-3-2-13(8-17)10-19-15/h2-3,9-11,14H,4-7H2,1H3
InChIKeyZBBSRHKUSLMHPA-UHFFFAOYSA-N
XLogP2.10
TPSA74.93 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.35
LogP ≤ 52.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

2-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]oxy-6-methylpyrazine
CID 171700909
2-methyl-6-(1-pyrimidin-4-ylpiperidin-4-yl)oxypyrazine
CID 171701885
2-[1-(6-methoxypyrimidin-4-yl)piperidin-4-yl]oxy-6-methylpyrazine
CID 171702056
6-[4-[(3,6-dimethylpyrazin-2-yl)amino]piperidin-1-yl]pyridine-3-carbonitrile
CID 133469882
6-[4-[(6-methyl-2-pyridinyl)oxymethyl]piperidin-1-yl]pyridine-3-carbonitrile
CID 126875911
6-[3-(5-methylpyrimidin-2-yl)oxypyrrolidin-1-yl]pyridine-3-carbonitrile
CID 171701989
6-[4-(2-chlorophenoxy)piperidin-1-yl]pyridine-3-carbonitrile
CID 133391014
6-(4-piperidin-4-yloxypiperidin-1-yl)pyridine-3-carbonitrile
CID 69354590
6-[4-(3,4-difluorophenoxy)piperidin-1-yl]pyridine-3-carbonitrile
CID 154778818
6-[4-(dimethylamino)piperidin-1-yl]pyridine-3-carbonitrile
CID 43430337
6-(4-propan-2-ylpiperidin-1-yl)pyridine-3-carbonitrile
CID 58431342
6-[4-[(4-methoxypyrimidin-2-yl)amino]piperidin-1-yl]pyridine-3-carbonitrile
CID 133286804

Frequently Asked Questions

What is the IUPAC name of 6-[4-(6-methylpyrazin-2-yl)oxypiperidin-1-yl]pyridine-3-carbonitrile?
The IUPAC name of 6-[4-(6-methylpyrazin-2-yl)oxypiperidin-1-yl]pyridine-3-carbonitrile (CID 171701933) is 6-[4-(6-methylpyrazin-2-yl)oxypiperidin-1-yl]pyridine-3-carbonitrile.
What is the SMILES notation for 6-[4-(6-methylpyrazin-2-yl)oxypiperidin-1-yl]pyridine-3-carbonitrile?
The canonical SMILES for 6-[4-(6-methylpyrazin-2-yl)oxypiperidin-1-yl]pyridine-3-carbonitrile is Cc1cncc(OC2CCN(c3ccc(C#N)cn3)CC2)n1.
What is the InChIKey of 6-[4-(6-methylpyrazin-2-yl)oxypiperidin-1-yl]pyridine-3-carbonitrile?
The InChIKey is ZBBSRHKUSLMHPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N5O/c1-12-9-18-11-16(20-12)22-14-4-6-21(7-5-14)15-3-2-13(8-17)10-19-15/h2-3,9-11,14H,4-7H2,1H3.
What are the key properties of 6-[4-(6-methylpyrazin-2-yl)oxypiperidin-1-yl]pyridine-3-carbonitrile?
6-[4-(6-methylpyrazin-2-yl)oxypiperidin-1-yl]pyridine-3-carbonitrile has a molecular weight of 295.35 g/mol, XLogP of 2.10, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-(6-methylpyrazin-2-yl)oxypiperidin-1-yl]pyridine-3-carbonitrile is sourced from PubChem (CID 171701933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).