ethane;1-propan-2-yl-4-(4-propan-2-ylcyclohexyl)piperazine

C18H38N2 — CID 171508742

IUPACethane;1-propan-2-yl-4-(4-propan-2-ylcyclohexyl)piperazine
SMILESCC.CC(C)C1CCC(N2CCN(C(C)C)CC2)CC1
InChIInChI=1S/C16H32N2.C2H6/c1-13(2)15-5-7-16(8-6-15)18-11-9-17(10-12-18)14(3)4;1-2/h13-16H,5-12H2,1-4H3;1-2H3
InChIKeyVDXWJCDVBGCCHG-UHFFFAOYSA-N
MW282.52 g/mol
LogP4.25
Rot. Bonds3

About ethane;1-propan-2-yl-4-(4-propan-2-ylcyclohexyl)piperazine

ethane;1-propan-2-yl-4-(4-propan-2-ylcyclohexyl)piperazine (PubChem CID 171508742) has the molecular formula C18H38N2 and a molecular weight of 282.52 g/mol. Its IUPAC name is ethane;1-propan-2-yl-4-(4-propan-2-ylcyclohexyl)piperazine.

Molecular Properties

Compound Nameethane;1-propan-2-yl-4-(4-propan-2-ylcyclohexyl)piperazine
PubChem CID171508742
Molecular FormulaC18H38N2
Molecular Weight282.52 g/mol
Exact Mass282.30
IUPAC Nameethane;1-propan-2-yl-4-(4-propan-2-ylcyclohexyl)piperazine
SMILESCC.CC(C)C1CCC(N2CCN(C(C)C)CC2)CC1
InChIInChI=1S/C16H32N2.C2H6/c1-13(2)15-5-7-16(8-6-15)18-11-9-17(10-12-18)14(3)4;1-2/h13-16H,5-12H2,1-4H3;1-2H3
InChIKeyVDXWJCDVBGCCHG-UHFFFAOYSA-N
XLogP4.25
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.52
LogP ≤ 54.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze ethane;1-propan-2-yl-4-(4-propan-2-ylcyclohexyl)piperazine 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

1-cyclopropyl-4-propan-2-ylpiperazine;ethane
CID 169164545
1-cyclopropyl-4-propan-2-ylpiperazine
CID 59855791
[1-(4-propan-2-ylcyclohexyl)piperidin-4-yl]-(4-propan-2-ylpiperazin-1-yl)methanone
CID 176796856
1,4-di(propan-2-yl)piperidine
CID 21303253
butane;1,4-di(propan-2-yl)piperazine;1,4-di(propan-2-yl)piperidine;ethane
CID 168928365
4-fluoro-1-(4-propan-2-ylcyclohexyl)piperidine
CID 58386347
1-propan-2-yl-4-(1-propan-2-ylpyrrolidin-3-yl)piperazine
CID 58904691
4-(4-propan-2-ylcyclohexyl)morpholin-1-ium
CID 147375805
1-(1-cyclohexylazetidin-3-yl)-4-propan-2-ylpiperazine
CID 126892268
2-[4-(4-propan-2-ylpiperazin-1-yl)cyclohexyl]ethanol
CID 156683774
4-(azetidin-1-yl)-1-propan-2-ylpiperidine
CID 21054794
1-cyclopropyl-4-(3-methylbutan-2-yl)piperazine
CID 138669145

Frequently Asked Questions

What is the IUPAC name of ethane;1-propan-2-yl-4-(4-propan-2-ylcyclohexyl)piperazine?
The IUPAC name of ethane;1-propan-2-yl-4-(4-propan-2-ylcyclohexyl)piperazine (CID 171508742) is ethane;1-propan-2-yl-4-(4-propan-2-ylcyclohexyl)piperazine.
What is the SMILES notation for ethane;1-propan-2-yl-4-(4-propan-2-ylcyclohexyl)piperazine?
The canonical SMILES for ethane;1-propan-2-yl-4-(4-propan-2-ylcyclohexyl)piperazine is CC.CC(C)C1CCC(N2CCN(C(C)C)CC2)CC1.
What is the InChIKey of ethane;1-propan-2-yl-4-(4-propan-2-ylcyclohexyl)piperazine?
The InChIKey is VDXWJCDVBGCCHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2.C2H6/c1-13(2)15-5-7-16(8-6-15)18-11-9-17(10-12-18)14(3)4;1-2/h13-16H,5-12H2,1-4H3;1-2H3.
What are the key properties of ethane;1-propan-2-yl-4-(4-propan-2-ylcyclohexyl)piperazine?
ethane;1-propan-2-yl-4-(4-propan-2-ylcyclohexyl)piperazine has a molecular weight of 282.52 g/mol, XLogP of 4.25, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1-propan-2-yl-4-(4-propan-2-ylcyclohexyl)piperazine is sourced from PubChem (CID 171508742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).