2-[4-(1-cyclobutylpiperidin-4-yl)oxypiperidin-1-yl]-5-(trifluoromethyl)pyrazine

C19H27F3N4O — CID 58747986

IUPAC2-[4-(1-cyclobutylpiperidin-4-yl)oxypiperidin-1-yl]-5-(trifluoromethyl)pyrazine
SMILESFC(F)(F)c1cnc(N2CCC(OC3CCN(C4CCC4)CC3)CC2)cn1
InChIInChI=1S/C19H27F3N4O/c20-19(21,22)17-12-24-18(13-23-17)26-10-6-16(7-11-26)27-15-4-8-25(9-5-15)14-2-1-3-14/h12-16H,1-11H2
InChIKeyABHPBERICQJSJR-UHFFFAOYSA-N
MW384.45 g/mol
LogP3.50
Rot. Bonds4

About 2-[4-(1-cyclobutylpiperidin-4-yl)oxypiperidin-1-yl]-5-(trifluoromethyl)pyrazine

2-[4-(1-cyclobutylpiperidin-4-yl)oxypiperidin-1-yl]-5-(trifluoromethyl)pyrazine (PubChem CID 58747986) has the molecular formula C19H27F3N4O and a molecular weight of 384.45 g/mol. Its IUPAC name is 2-[4-(1-cyclobutylpiperidin-4-yl)oxypiperidin-1-yl]-5-(trifluoromethyl)pyrazine.

Molecular Properties

Compound Name2-[4-(1-cyclobutylpiperidin-4-yl)oxypiperidin-1-yl]-5-(trifluoromethyl)pyrazine
PubChem CID58747986
Molecular FormulaC19H27F3N4O
Molecular Weight384.45 g/mol
Exact Mass384.21
IUPAC Name2-[4-(1-cyclobutylpiperidin-4-yl)oxypiperidin-1-yl]-5-(trifluoromethyl)pyrazine
SMILESFC(F)(F)c1cnc(N2CCC(OC3CCN(C4CCC4)CC3)CC2)cn1
InChIInChI=1S/C19H27F3N4O/c20-19(21,22)17-12-24-18(13-23-17)26-10-6-16(7-11-26)27-15-4-8-25(9-5-15)14-2-1-3-14/h12-16H,1-11H2
InChIKeyABHPBERICQJSJR-UHFFFAOYSA-N
XLogP3.50
TPSA41.49 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.45
LogP ≤ 53.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 2-[4-(1-cyclobutylpiperidin-4-yl)oxypiperidin-1-yl]-5-(trifluoromethyl)pyrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[4-(1-Propan-2-ylpiperidin-4-yl)oxypiperidin-1-yl]-5-(trifluoromethyl)pyrazine
CID 58747946
2-{4-[(1-Cyclobutyl-4-piperidinyl)oxy]-1-piperidinyl}-5-(trifluoromethyl)pyrazine hydrochloride
CID 69353961
2-[4-(1-Propan-2-ylpiperidin-4-yl)oxypiperidin-1-yl]-5-(trifluoromethyl)pyrazine;hydrochloride
CID 69355686
5-[[3-(Difluoromethoxy)cyclobutyl]-methylamino]pyrazine-2-carbonitrile
CID 174277738
4-Methyl-9-[3-(trifluoromethyl)pyrazin-2-yl]-1-oxa-4,9-diazaspiro[5.5]undecane
CID 166342246
2-[3-(4-Methylpiperazin-1-yl)piperidin-1-yl]-3-(trifluoromethyl)pyrazine
CID 166357290
3-[4-[3-(Dimethylamino)propoxy]piperidin-1-yl]pyrazine-2-carbonitrile
CID 72105909
3-{4-[2-(1,4-Dioxan-2-yl)ethyl]-1-piperazinyl}-2,5-dimethylpyrazine
CID 138810440
2-(4-Methoxypiperidin-1-yl)-6-methylpyrazine
CID 174629631
3-(4-Ethoxypiperidin-1-yl)pyrazine-2-carbonitrile
CID 62685554
5-(4-Ethoxypiperidin-1-yl)pyrazine-2-carbonitrile
CID 64271717
(2R*,6S*)-4-[1-(3,6-dimethyl-2-pyrazinyl)-4-piperidinyl]-2,6-dimethylmorpholine
CID 70727565

Frequently Asked Questions

What is the IUPAC name of 2-[4-(1-cyclobutylpiperidin-4-yl)oxypiperidin-1-yl]-5-(trifluoromethyl)pyrazine?
The IUPAC name of 2-[4-(1-cyclobutylpiperidin-4-yl)oxypiperidin-1-yl]-5-(trifluoromethyl)pyrazine (CID 58747986) is 2-[4-(1-cyclobutylpiperidin-4-yl)oxypiperidin-1-yl]-5-(trifluoromethyl)pyrazine.
What is the SMILES notation for 2-[4-(1-cyclobutylpiperidin-4-yl)oxypiperidin-1-yl]-5-(trifluoromethyl)pyrazine?
The canonical SMILES for 2-[4-(1-cyclobutylpiperidin-4-yl)oxypiperidin-1-yl]-5-(trifluoromethyl)pyrazine is FC(F)(F)c1cnc(N2CCC(OC3CCN(C4CCC4)CC3)CC2)cn1.
What is the InChIKey of 2-[4-(1-cyclobutylpiperidin-4-yl)oxypiperidin-1-yl]-5-(trifluoromethyl)pyrazine?
The InChIKey is ABHPBERICQJSJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27F3N4O/c20-19(21,22)17-12-24-18(13-23-17)26-10-6-16(7-11-26)27-15-4-8-25(9-5-15)14-2-1-3-14/h12-16H,1-11H2.
What are the key properties of 2-[4-(1-cyclobutylpiperidin-4-yl)oxypiperidin-1-yl]-5-(trifluoromethyl)pyrazine?
2-[4-(1-cyclobutylpiperidin-4-yl)oxypiperidin-1-yl]-5-(trifluoromethyl)pyrazine has a molecular weight of 384.45 g/mol, XLogP of 3.50, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(1-cyclobutylpiperidin-4-yl)oxypiperidin-1-yl]-5-(trifluoromethyl)pyrazine is sourced from PubChem (CID 58747986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).