2-methyl-6-[4-(trifluoromethyl)piperidin-1-yl]pyrazine

C11H14F3N3 — CID 126811084

IUPAC2-methyl-6-[4-(trifluoromethyl)piperidin-1-yl]pyrazine
SMILESCc1cncc(N2CCC(C(F)(F)F)CC2)n1
InChIInChI=1S/C11H14F3N3/c1-8-6-15-7-10(16-8)17-4-2-9(3-5-17)11(12,13)14/h6-7,9H,2-5H2,1H3
InChIKeyNXWVHZLMBHFXSA-UHFFFAOYSA-N
MW245.25 g/mol
LogP2.56
Rot. Bonds1

About 2-methyl-6-[4-(trifluoromethyl)piperidin-1-yl]pyrazine

2-methyl-6-[4-(trifluoromethyl)piperidin-1-yl]pyrazine (PubChem CID 126811084) has the molecular formula C11H14F3N3 and a molecular weight of 245.25 g/mol. Its IUPAC name is 2-methyl-6-[4-(trifluoromethyl)piperidin-1-yl]pyrazine.

Molecular Properties

Compound Name2-methyl-6-[4-(trifluoromethyl)piperidin-1-yl]pyrazine
PubChem CID126811084
Molecular FormulaC11H14F3N3
Molecular Weight245.25 g/mol
Exact Mass245.11
IUPAC Name2-methyl-6-[4-(trifluoromethyl)piperidin-1-yl]pyrazine
SMILESCc1cncc(N2CCC(C(F)(F)F)CC2)n1
InChIInChI=1S/C11H14F3N3/c1-8-6-15-7-10(16-8)17-4-2-9(3-5-17)11(12,13)14/h6-7,9H,2-5H2,1H3
InChIKeyNXWVHZLMBHFXSA-UHFFFAOYSA-N
XLogP2.56
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.25
LogP ≤ 52.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

Modaline
CID 17860
Pyrazine, 2-methyl-3-piperidino-, monohydrochloride
CID 83550
N,N-diethyl-2-[4-(5-methylpyrazin-2-yl)piperazin-1-yl]ethanamine
CID 49778905
6-(1-ethylpiperidin-4-yl)-N,N-dimethylpyrazin-2-amine
CID 73439105
1-(6-Methylpyrazin-2-yl)piperidine-4-carbaldehyde
CID 18525897
3-[4-(3,6-dimethyl-2-pyrazinyl)-1-piperazinyl]-N,N-diethyl-1-propanamine
CID 29188695
3-[2-[1-(2,2,2-Trifluoroethyl)piperidin-4-yl]ethylamino]pyrazine-2-carbonitrile
CID 71978663
N,N-dimethyl-6-(1-methylpiperidin-4-yl)pyrazin-2-amine
CID 95730773
N-(2,2-difluoroethyl)-5-piperidin-4-ylpyrazin-2-amine
CID 95846722
N,N-dimethyl-N'-[5-(trifluoromethyl)pyrazin-2-yl]methanimidamide
CID 164682790
N,N-dimethyl-N'-[3-methyl-5-(trifluoromethyl)pyrazin-2-yl]methanimidamide
CID 164683015
3-(4-(Aminomethyl)piperidin-1-yl)pyrazine-2-carbonitrile
CID 62674127

Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-[4-(trifluoromethyl)piperidin-1-yl]pyrazine?
The IUPAC name of 2-methyl-6-[4-(trifluoromethyl)piperidin-1-yl]pyrazine (CID 126811084) is 2-methyl-6-[4-(trifluoromethyl)piperidin-1-yl]pyrazine.
What is the SMILES notation for 2-methyl-6-[4-(trifluoromethyl)piperidin-1-yl]pyrazine?
The canonical SMILES for 2-methyl-6-[4-(trifluoromethyl)piperidin-1-yl]pyrazine is Cc1cncc(N2CCC(C(F)(F)F)CC2)n1.
What is the InChIKey of 2-methyl-6-[4-(trifluoromethyl)piperidin-1-yl]pyrazine?
The InChIKey is NXWVHZLMBHFXSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14F3N3/c1-8-6-15-7-10(16-8)17-4-2-9(3-5-17)11(12,13)14/h6-7,9H,2-5H2,1H3.
What are the key properties of 2-methyl-6-[4-(trifluoromethyl)piperidin-1-yl]pyrazine?
2-methyl-6-[4-(trifluoromethyl)piperidin-1-yl]pyrazine has a molecular weight of 245.25 g/mol, XLogP of 2.56, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-[4-(trifluoromethyl)piperidin-1-yl]pyrazine is sourced from PubChem (CID 126811084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).