tert-butyl 4-(6-methylpyrazin-2-yl)oxypiperidine-1-carboxylate

C15H23N3O3 — CID 155941356

IUPACtert-butyl 4-(6-methylpyrazin-2-yl)oxypiperidine-1-carboxylate
SMILESCc1cncc(OC2CCN(C(=O)OC(C)(C)C)CC2)n1
InChIInChI=1S/C15H23N3O3/c1-11-9-16-10-13(17-11)20-12-5-7-18(8-6-12)14(19)21-15(2,3)4/h9-10,12H,5-8H2,1-4H3
InChIKeyQOCZAYQVJBURNR-UHFFFAOYSA-N
MW293.37 g/mol
LogP2.56
Rot. Bonds2

About tert-butyl 4-(6-methylpyrazin-2-yl)oxypiperidine-1-carboxylate

tert-butyl 4-(6-methylpyrazin-2-yl)oxypiperidine-1-carboxylate (PubChem CID 155941356) has the molecular formula C15H23N3O3 and a molecular weight of 293.37 g/mol. Its IUPAC name is tert-butyl 4-(6-methylpyrazin-2-yl)oxypiperidine-1-carboxylate.

Molecular Properties

Compound Nametert-butyl 4-(6-methylpyrazin-2-yl)oxypiperidine-1-carboxylate
PubChem CID155941356
Molecular FormulaC15H23N3O3
Molecular Weight293.37 g/mol
Exact Mass293.17
IUPAC Nametert-butyl 4-(6-methylpyrazin-2-yl)oxypiperidine-1-carboxylate
SMILESCc1cncc(OC2CCN(C(=O)OC(C)(C)C)CC2)n1
InChIInChI=1S/C15H23N3O3/c1-11-9-16-10-13(17-11)20-12-5-7-18(8-6-12)14(19)21-15(2,3)4/h9-10,12H,5-8H2,1-4H3
InChIKeyQOCZAYQVJBURNR-UHFFFAOYSA-N
XLogP2.56
TPSA64.55 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 52.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

Tert-butyl 4-[4-(5-cyanopyrazin-2-yl)oxycyclohexyl]oxypiperidine-1-carboxylate
CID 68230201
tert-butyl (2S,4S)-4-methyl-2-[[5-(trifluoromethyl)pyrazin-2-yl]oxymethyl]piperidine-1-carboxylate
CID 68046220
(2S,3R)-2-methyl-3-[5-(trifluoromethyl)pyrazin-2-yl]oxypiperidine-1-carbaldehyde
CID 134495378
Tert-butyl 3-[6-(trifluoromethyl)pyrazin-2-yl]oxyazetidine-1-carboxylate
CID 166520413
tert-butyl (3R,4S)-3-fluoro-4-[5-(2-hydroxypropan-2-yl)pyrazin-2-yl]oxypiperidine-1-carboxylate
CID 178170933
Tert-butyl 4-(pyrazin-2-yloxy)piperidine-1-carboxylate
CID 21906105
Tert-butyl 2-[[5-(trifluoromethyl)pyrazin-2-yl]oxymethyl]pyrrolidine-1-carboxylate
CID 170977474
2-Methyl-6-{[1-(3,3,3-trifluoropropyl)piperidin-4-yl]oxy}pyrazine
CID 171700819
2-({1-[(3,3-Difluorocyclobutyl)methyl]piperidin-4-yl}oxy)-6-methylpyrazine
CID 171700824
2-Methyl-6-{[1-(2,2,2-trifluoroethyl)piperidin-4-yl]oxy}pyrazine
CID 171701599
2-{[1-(2,2-Difluoroethyl)piperidin-4-yl]oxy}-6-methylpyrazine
CID 171704114
2-{[1-(3-Fluoropropyl)piperidin-4-yl]oxy}-6-methylpyrazine
CID 171704144

Frequently Asked Questions

What is the IUPAC name of tert-butyl 4-(6-methylpyrazin-2-yl)oxypiperidine-1-carboxylate?
The IUPAC name of tert-butyl 4-(6-methylpyrazin-2-yl)oxypiperidine-1-carboxylate (CID 155941356) is tert-butyl 4-(6-methylpyrazin-2-yl)oxypiperidine-1-carboxylate.
What is the SMILES notation for tert-butyl 4-(6-methylpyrazin-2-yl)oxypiperidine-1-carboxylate?
The canonical SMILES for tert-butyl 4-(6-methylpyrazin-2-yl)oxypiperidine-1-carboxylate is Cc1cncc(OC2CCN(C(=O)OC(C)(C)C)CC2)n1.
What is the InChIKey of tert-butyl 4-(6-methylpyrazin-2-yl)oxypiperidine-1-carboxylate?
The InChIKey is QOCZAYQVJBURNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O3/c1-11-9-16-10-13(17-11)20-12-5-7-18(8-6-12)14(19)21-15(2,3)4/h9-10,12H,5-8H2,1-4H3.
What are the key properties of tert-butyl 4-(6-methylpyrazin-2-yl)oxypiperidine-1-carboxylate?
tert-butyl 4-(6-methylpyrazin-2-yl)oxypiperidine-1-carboxylate has a molecular weight of 293.37 g/mol, XLogP of 2.56, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl 4-(6-methylpyrazin-2-yl)oxypiperidine-1-carboxylate is sourced from PubChem (CID 155941356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).