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

C15H19N3S — CID 125019406

IUPAC2-methyl-6-[1-(thiophen-2-ylmethyl)piperidin-4-yl]pyrazine
SMILESCc1cncc(C2CCN(Cc3cccs3)CC2)n1
InChIInChI=1S/C15H19N3S/c1-12-9-16-10-15(17-12)13-4-6-18(7-5-13)11-14-3-2-8-19-14/h2-3,8-10,13H,4-7,11H2,1H3
InChIKeyXVUONZWLXNXGGX-UHFFFAOYSA-N
MW273.40 g/mol
LogP3.23
Rot. Bonds3

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

2-methyl-6-[1-(thiophen-2-ylmethyl)piperidin-4-yl]pyrazine (PubChem CID 125019406) has the molecular formula C15H19N3S and a molecular weight of 273.40 g/mol. Its IUPAC name is 2-methyl-6-[1-(thiophen-2-ylmethyl)piperidin-4-yl]pyrazine.

Molecular Properties

Compound Name2-methyl-6-[1-(thiophen-2-ylmethyl)piperidin-4-yl]pyrazine
PubChem CID125019406
Molecular FormulaC15H19N3S
Molecular Weight273.40 g/mol
Exact Mass273.13
IUPAC Name2-methyl-6-[1-(thiophen-2-ylmethyl)piperidin-4-yl]pyrazine
SMILESCc1cncc(C2CCN(Cc3cccs3)CC2)n1
InChIInChI=1S/C15H19N3S/c1-12-9-16-10-15(17-12)13-4-6-18(7-5-13)11-14-3-2-8-19-14/h2-3,8-10,13H,4-7,11H2,1H3
InChIKeyXVUONZWLXNXGGX-UHFFFAOYSA-N
XLogP3.23
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.40
LogP ≤ 53.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

5-[[4-(6-methylpyrazin-2-yl)piperidin-1-yl]methyl]-1,3-thiazole
CID 125023271
1,4-dimethyl-2-[(3S)-1-(thiophen-2-ylmethyl)pyrrolidin-3-yl]imidazole
CID 124959858
3,6-dimethyl-N-[[1-(thiophen-2-ylmethyl)piperidin-4-yl]methyl]pyrazin-2-amine
CID 133469202
N-methyl-1-(thiophen-2-ylmethyl)pyrrolidin-3-amine
CID 60861984
1-[(2R)-2-(6-methylpyrazin-2-yl)pyrrolidin-1-yl]-2-thiophen-2-ylethanone
CID 124997340
1-(thiophen-2-ylmethyl)piperidin-4-amine;dihydrochloride
CID 22748866
3-(chloromethyl)-1-(thiophen-2-ylmethyl)pyrrolidine
CID 63388749
3-(2-methylphenyl)-5-[1-(thiophen-2-ylmethyl)pyrrolidin-3-yl]-1,2,4-oxadiazole
CID 127244653
N-cyclohexyl-N,6-dimethyl-2-[1-(thiophen-2-ylmethyl)piperidin-4-yl]pyridine-3-carboxamide
CID 46044896
3-chloro-4-methyl-1-(thiophen-2-ylmethyl)piperidine
CID 102959815
6-(3,5-dimethylpyrazol-1-yl)-N-[[1-(thiophen-2-ylmethyl)piperidin-4-yl]methyl]pyrazin-2-amine
CID 133284621
3-propyl-2-[1-(thiophen-2-ylmethyl)pyrrolidin-3-yl]imidazo[4,5-b]pyridine
CID 53191350

Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-[1-(thiophen-2-ylmethyl)piperidin-4-yl]pyrazine?
The IUPAC name of 2-methyl-6-[1-(thiophen-2-ylmethyl)piperidin-4-yl]pyrazine (CID 125019406) is 2-methyl-6-[1-(thiophen-2-ylmethyl)piperidin-4-yl]pyrazine.
What is the SMILES notation for 2-methyl-6-[1-(thiophen-2-ylmethyl)piperidin-4-yl]pyrazine?
The canonical SMILES for 2-methyl-6-[1-(thiophen-2-ylmethyl)piperidin-4-yl]pyrazine is Cc1cncc(C2CCN(Cc3cccs3)CC2)n1.
What is the InChIKey of 2-methyl-6-[1-(thiophen-2-ylmethyl)piperidin-4-yl]pyrazine?
The InChIKey is XVUONZWLXNXGGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3S/c1-12-9-16-10-15(17-12)13-4-6-18(7-5-13)11-14-3-2-8-19-14/h2-3,8-10,13H,4-7,11H2,1H3.
What are the key properties of 2-methyl-6-[1-(thiophen-2-ylmethyl)piperidin-4-yl]pyrazine?
2-methyl-6-[1-(thiophen-2-ylmethyl)piperidin-4-yl]pyrazine has a molecular weight of 273.40 g/mol, XLogP of 3.23, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-[1-(thiophen-2-ylmethyl)piperidin-4-yl]pyrazine is sourced from PubChem (CID 125019406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).