2-cyclohexyl-1-[4-(6-methylpyrazin-2-yl)piperazin-1-yl]ethanone

C17H26N4O — CID 133469560

IUPAC2-cyclohexyl-1-[4-(6-methylpyrazin-2-yl)piperazin-1-yl]ethanone
SMILESCc1cncc(N2CCN(C(=O)CC3CCCCC3)CC2)n1
InChIInChI=1S/C17H26N4O/c1-14-12-18-13-16(19-14)20-7-9-21(10-8-20)17(22)11-15-5-3-2-4-6-15/h12-13,15H,2-11H2,1H3
InChIKeyHRLVTRZUKGLGGN-UHFFFAOYSA-N
MW302.42 g/mol
LogP2.40
Rot. Bonds3

About 2-cyclohexyl-1-[4-(6-methylpyrazin-2-yl)piperazin-1-yl]ethanone

2-cyclohexyl-1-[4-(6-methylpyrazin-2-yl)piperazin-1-yl]ethanone (PubChem CID 133469560) has the molecular formula C17H26N4O and a molecular weight of 302.42 g/mol. Its IUPAC name is 2-cyclohexyl-1-[4-(6-methylpyrazin-2-yl)piperazin-1-yl]ethanone.

Molecular Properties

Compound Name2-cyclohexyl-1-[4-(6-methylpyrazin-2-yl)piperazin-1-yl]ethanone
PubChem CID133469560
Molecular FormulaC17H26N4O
Molecular Weight302.42 g/mol
Exact Mass302.21
IUPAC Name2-cyclohexyl-1-[4-(6-methylpyrazin-2-yl)piperazin-1-yl]ethanone
SMILESCc1cncc(N2CCN(C(=O)CC3CCCCC3)CC2)n1
InChIInChI=1S/C17H26N4O/c1-14-12-18-13-16(19-14)20-7-9-21(10-8-20)17(22)11-15-5-3-2-4-6-15/h12-13,15H,2-11H2,1H3
InChIKeyHRLVTRZUKGLGGN-UHFFFAOYSA-N
XLogP2.40
TPSA49.33 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.42
LogP ≤ 52.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-2-[1-(6-methylpyrazin-2-yl)piperidin-4-yl]ethanone
CID 172891275
1-[4-(2-amino-6-methylpyrimidin-4-yl)piperazin-1-yl]-2-cyclohexylethanone
CID 51106955
2-cyclohexyl-1-[4-[6-(4-methylpiperazin-1-yl)pyridazin-3-yl]piperazin-1-yl]ethanone
CID 121053550
2-cyclohexyl-1-[4-[6-(4-methylpiperidin-1-yl)pyridazin-3-yl]piperazin-1-yl]ethanone
CID 121053451
ethane;methanol;2-methyl-6-pyrrolidin-1-ylpyrazine
CID 169251343
3-[1-(6-methylpyrazin-2-yl)piperidin-3-yl]propanamide
CID 133469915
2-(4-cyclopropylpiperazin-1-yl)-6-methylpyrazine
CID 133468968
N,N-diethyl-1-(6-methylpyrazin-2-yl)piperidine-4-carboxamide
CID 133469122
2-cyclopentyl-1-[4-(2-pyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]ethanone
CID 122343767
2-cyclohexyl-1-[4-[6-(1,2,4-triazol-1-yl)pyrimidin-4-yl]piperazin-1-yl]ethanone
CID 90626424
2-cyclopentyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone
CID 78768063
2-cyclohexyl-1-(4-phenylpiperazin-1-yl)ethanone
CID 806694

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-1-[4-(6-methylpyrazin-2-yl)piperazin-1-yl]ethanone?
The IUPAC name of 2-cyclohexyl-1-[4-(6-methylpyrazin-2-yl)piperazin-1-yl]ethanone (CID 133469560) is 2-cyclohexyl-1-[4-(6-methylpyrazin-2-yl)piperazin-1-yl]ethanone.
What is the SMILES notation for 2-cyclohexyl-1-[4-(6-methylpyrazin-2-yl)piperazin-1-yl]ethanone?
The canonical SMILES for 2-cyclohexyl-1-[4-(6-methylpyrazin-2-yl)piperazin-1-yl]ethanone is Cc1cncc(N2CCN(C(=O)CC3CCCCC3)CC2)n1.
What is the InChIKey of 2-cyclohexyl-1-[4-(6-methylpyrazin-2-yl)piperazin-1-yl]ethanone?
The InChIKey is HRLVTRZUKGLGGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N4O/c1-14-12-18-13-16(19-14)20-7-9-21(10-8-20)17(22)11-15-5-3-2-4-6-15/h12-13,15H,2-11H2,1H3.
What are the key properties of 2-cyclohexyl-1-[4-(6-methylpyrazin-2-yl)piperazin-1-yl]ethanone?
2-cyclohexyl-1-[4-(6-methylpyrazin-2-yl)piperazin-1-yl]ethanone has a molecular weight of 302.42 g/mol, XLogP of 2.40, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-1-[4-(6-methylpyrazin-2-yl)piperazin-1-yl]ethanone is sourced from PubChem (CID 133469560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).