1-tert-butylpiperazin-4-ide;1-tert-butylpiperidine;2-tert-butylpiperidin-1-ide;3-tert-butylpiperidin-1-ide;4-tert-butylpiperidin-1-ide;1-tert-butylpyrrolidine;2-tert-butylpyrrolidin-1-ide;3-tert-butylpyrrolidin-1-ide;ethane;tungsten

C84H187N9W6-6 — CID 157322500

IUPAC1-tert-butylpiperazin-4-ide;1-tert-butylpiperidine;2-tert-butylpiperidin-1-ide;3-tert-butylpiperidin-1-ide;4-tert-butylpiperidin-1-ide;1-tert-butylpyrrolidine;2-tert-butylpyrrolidin-1-ide;3-tert-butylpyrrolidin-1-ide;ethane;tungsten
SMILESCC.CC.CC.CC.CC.CC.CC.CC.CC(C)(C)C1CCCC[N-]1.CC(C)(C)C1CCC[N-]1.CC(C)(C)C1CCC[N-]C1.CC(C)(C)C1CC[N-]C1.CC(C)(C)C1CC[N-]CC1.CC(C)(C)N1CCCC1.CC(C)(C)N1CCCCC1.CC(C)(C)N1CC[N-]CC1.[W].[W].[W].[W].[W].[W]
InChIInChI=1S/2C9H18N.C9H19N.C9H18N.C8H17N2.C8H16N.C8H17N.C8H16N.8C2H6.6W/c1-9(2,3)8-4-6-10-7-5-8;1-9(2,3)8-5-4-6-10-7-8;1-9(2,3)10-7-5-4-6-8-10;1-9(2,3)8-6-4-5-7-10-8;1-8(2,3)10-6-4-9-5-7-10;1-8(2,3)7-4-5-9-6-7;1-8(2,3)9-6-4-5-7-9;1-8(2,3)7-5-4-6-9-7;8*1-2;;;;;;/h2*8H,4-7H2,1-3H3;4-8H2,1-3H3;8H,4-7H2,1-3H3;4-7H2,1-3H3;7H,4-6H2,1-3H3;4-7H2,1-3H3;7H,4-6H2,1-3H3;8*1-2H3;;;;;;/q2*-1;;3*-1;;-1;;;;;;;;;;;;;;
InChIKeyYTHILAAOGBJRBX-UHFFFAOYSA-N
MW2426.52 g/mol
LogP27.41
Rot. Bonds

About 1-tert-butylpiperazin-4-ide;1-tert-butylpiperidine;2-tert-butylpiperidin-1-ide;3-tert-butylpiperidin-1-ide;4-tert-butylpiperidin-1-ide;1-tert-butylpyrrolidine;2-tert-butylpyrrolidin-1-ide;3-tert-butylpyrrolidin-1-ide;ethane;tungsten

1-tert-butylpiperazin-4-ide;1-tert-butylpiperidine;2-tert-butylpiperidin-1-ide;3-tert-butylpiperidin-1-ide;4-tert-butylpiperidin-1-ide;1-tert-butylpyrrolidine;2-tert-butylpyrrolidin-1-ide;3-tert-butylpyrrolidin-1-ide;ethane;tungsten (PubChem CID 157322500) has the molecular formula C84H187N9W6-6 and a molecular weight of 2426.52 g/mol. Its IUPAC name is 1-tert-butylpiperazin-4-ide;1-tert-butylpiperidine;2-tert-butylpiperidin-1-ide;3-tert-butylpiperidin-1-ide;4-tert-butylpiperidin-1-ide;1-tert-butylpyrrolidine;2-tert-butylpyrrolidin-1-ide;3-tert-butylpyrrolidin-1-ide;ethane;tungsten.

Molecular Properties

Compound Name1-tert-butylpiperazin-4-ide;1-tert-butylpiperidine;2-tert-butylpiperidin-1-ide;3-tert-butylpiperidin-1-ide;4-tert-butylpiperidin-1-ide;1-tert-butylpyrrolidine;2-tert-butylpyrrolidin-1-ide;3-tert-butylpyrrolidin-1-ide;ethane;tungsten
PubChem CID157322500
Molecular FormulaC84H187N9W6-6
Molecular Weight2426.52 g/mol
Exact Mass2426.20
IUPAC Name1-tert-butylpiperazin-4-ide;1-tert-butylpiperidine;2-tert-butylpiperidin-1-ide;3-tert-butylpiperidin-1-ide;4-tert-butylpiperidin-1-ide;1-tert-butylpyrrolidine;2-tert-butylpyrrolidin-1-ide;3-tert-butylpyrrolidin-1-ide;ethane;tungsten
SMILESCC.CC.CC.CC.CC.CC.CC.CC.CC(C)(C)C1CCCC[N-]1.CC(C)(C)C1CCC[N-]1.CC(C)(C)C1CCC[N-]C1.CC(C)(C)C1CC[N-]C1.CC(C)(C)C1CC[N-]CC1.CC(C)(C)N1CCCC1.CC(C)(C)N1CCCCC1.CC(C)(C)N1CC[N-]CC1.[W].[W].[W].[W].[W].[W]
InChIInChI=1S/2C9H18N.C9H19N.C9H18N.C8H17N2.C8H16N.C8H17N.C8H16N.8C2H6.6W/c1-9(2,3)8-4-6-10-7-5-8;1-9(2,3)8-5-4-6-10-7-8;1-9(2,3)10-7-5-4-6-8-10;1-9(2,3)8-6-4-5-7-10-8;1-8(2,3)10-6-4-9-5-7-10;1-8(2,3)7-4-5-9-6-7;1-8(2,3)9-6-4-5-7-9;1-8(2,3)7-5-4-6-9-7;8*1-2;;;;;;/h2*8H,4-7H2,1-3H3;4-8H2,1-3H3;8H,4-7H2,1-3H3;4-7H2,1-3H3;7H,4-6H2,1-3H3;4-7H2,1-3H3;7H,4-6H2,1-3H3;8*1-2H3;;;;;;/q2*-1;;3*-1;;-1;;;;;;;;;;;;;;
InChIKeyYTHILAAOGBJRBX-UHFFFAOYSA-N
XLogP27.41
TPSA94.32 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms99
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002426.52
LogP ≤ 527.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1-tert-butylpiperazin-4-ide;1-tert-butylpiperidine;2-tert-butylpiperidin-1-ide;3-tert-butylpiperidin-1-ide;4-tert-butylpiperidin-1-ide;1-tert-butylpyrrolidine;2-tert-butylpyrrolidin-1-ide;3-tert-butylpyrrolidin-1-ide;ethane;tungsten 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

Tris(4-tert-butyl-2-(4-tert-butylpiperidin-1-id-2-yl)piperidin-1-ide);ruthenium(6+)
CID 59100553
7-Tert-butyl-2-methyl-2,7-diazaspiro[4.5]decane;8-tert-butyl-2-methyl-2,8-diazaspiro[4.5]decane;6-tert-butyl-1-methyl-1,6-diazaspiro[2.5]octane;2-methyl-6-propan-2-yl-2-azaspiro[3.4]octane;1-methyl-9-propan-2-yl-1,9-diazaspiro[4.5]decane;2-methyl-9-propan-2-yl-2,9-diazaspiro[5.5]undecane;9-methyl-2-propan-2-yl-2,9-diazaspiro[5.5]undecane;9-methyl-3-propan-2-yl-3,9-diazaspiro[5.5]undecane
CID 157079275
2-Methyl-7-propan-2-yl-7-azaspiro[3.5]nonane;1-methyl-9-propan-2-yl-1,9-diazaspiro[4.5]decane;2-methyl-7-propan-2-yl-2,7-diazaspiro[4.5]decane;2-methyl-6-propan-2-yl-2,6-diazaspiro[3.4]octane;2-methyl-9-propan-2-yl-2,9-diazaspiro[5.5]undecane;9-methyl-2-propan-2-yl-2,9-diazaspiro[5.5]undecane;9-methyl-3-propan-2-yl-3,9-diazaspiro[5.5]undecane
CID 157345444
1,3-di(propan-2-yl)piperidine;tris(1,4-di(propan-2-yl)piperidine);(3R)-1,3-di(propan-2-yl)piperidine;(3S)-1,3-di(propan-2-yl)piperidine;1,3-di(propan-2-yl)pyrrolidine;(3S)-1,3-di(propan-2-yl)pyrrolidine;(3R)-1,3-di(propan-2-yl)pyrrolidine
CID 157814797
bis(1-tert-butyl-4-[(4-tert-butylpiperidin-1-yl)methyl]piperidine);bis(4-tert-butyl-1-[[(3S)-1-tert-butylpyrrolidin-3-yl]methyl]piperidine);bis(4-tert-butyl-1-[[(3R)-1-tert-butylpyrrolidin-3-yl]methyl]piperidine)
CID 158088285
1,3-Di(propan-2-yl)piperidine;2-(3-methylbutyl)-1-propan-2-ylpiperidine;3-(3-methylbutyl)-1-propan-2-ylpiperidine;3-methyl-1,3-di(propan-2-yl)piperidine;1-(2-methylpropyl)-7-propan-2-yl-7-azabicyclo[2.2.1]heptane;2-(2-methylpropyl)-1-propan-2-ylpiperidine;3-(2-methylpropyl)-1-propan-2-ylpiperidine;4-(2-methylpropyl)-1-propan-2-ylpiperidine
CID 158532921
1-tert-butyl-2-(2,2-dimethylpropyl)piperidine;(2S)-1-tert-butyl-2-methylpiperidine;(2R)-1-tert-butyl-2-methylpyrrolidine;(2S)-1-tert-butyl-2-methylpyrrolidine;1,2-ditert-butylpiperidine;1,3-ditert-butylpiperidine;(2S)-1,2-ditert-butylpiperidine;ethane;propane
CID 158654218
1-Tert-butyl-4-propan-2-ylpiperazine;1-tert-butyl-4-propan-2-ylpiperidine;4-tert-butyl-1-propan-2-ylpiperidine;2,5-ditert-butyl-2,5-diazabicyclo[2.2.1]heptane;3,6-ditert-butyl-3,6-diazabicyclo[3.1.1]heptane;bis(1,3-ditert-butylpyrrolidine)
CID 158943851
Tert-butylcyclohexane;bis(4-tert-butyl-1-methylpiperidine);tris(1-(3,3-dimethylbutyl)-4-methylpiperazine);1-(3,3-dimethylbutyl)piperidine;1-(3,3-dimethylbutyl)pyrrolidine;tris(3-(2,2-dimethylpropyl)-1-methylpiperidine);tris(4-(2,2-dimethylpropyl)-1-methylpiperidine);2-(2,2-dimethylpropyl)-1-methylpyrrolidine;tris(3-(2,2-dimethylpropyl)-1-methylpyrrolidine);methane
CID 159046914
1,2-Ditert-butyldiazinane;1,3-ditert-butyl-1,3-diazinane;1,3-ditert-butylimidazolidine;1,4-ditert-butylpiperazine;1,2-ditert-butylpiperidine;1,3-ditert-butylpiperidine;1,4-ditert-butylpiperidine;1,2-ditert-butylpyrazolidine;1,2-ditert-butylpyrrolidine;1,3-ditert-butylpyrrolidine
CID 159600120
1-tert-butyl-2-(2,2-dimethylpropyl)piperidine;1-tert-butyl-2-methylpiperidine;(2S)-1-tert-butyl-2-methylpiperidine;(2R)-1-tert-butyl-2-methylpyrrolidine;(2S)-1-tert-butyl-2-methylpyrrolidine;1,2-ditert-butylpiperidine;1,3-ditert-butylpiperidine;ethane
CID 159665952
1-tert-butyl-2-(2,2-dimethylpropyl)piperidine;1-tert-butyl-2-methylpiperidine;(2S)-1-tert-butyl-2-methylpiperidine;(2R)-1-tert-butyl-2-methylpyrrolidine;(2S)-1-tert-butyl-2-methylpyrrolidine;1,2-ditert-butylpiperidine;1,3-ditert-butylpiperidine;1,2-ditert-butylpyrrolidine;ethane
CID 159956624

Frequently Asked Questions

What is the IUPAC name of 1-tert-butylpiperazin-4-ide;1-tert-butylpiperidine;2-tert-butylpiperidin-1-ide;3-tert-butylpiperidin-1-ide;4-tert-butylpiperidin-1-ide;1-tert-butylpyrrolidine;2-tert-butylpyrrolidin-1-ide;3-tert-butylpyrrolidin-1-ide;ethane;tungsten?
The IUPAC name of 1-tert-butylpiperazin-4-ide;1-tert-butylpiperidine;2-tert-butylpiperidin-1-ide;3-tert-butylpiperidin-1-ide;4-tert-butylpiperidin-1-ide;1-tert-butylpyrrolidine;2-tert-butylpyrrolidin-1-ide;3-tert-butylpyrrolidin-1-ide;ethane;tungsten (CID 157322500) is 1-tert-butylpiperazin-4-ide;1-tert-butylpiperidine;2-tert-butylpiperidin-1-ide;3-tert-butylpiperidin-1-ide;4-tert-butylpiperidin-1-ide;1-tert-butylpyrrolidine;2-tert-butylpyrrolidin-1-ide;3-tert-butylpyrrolidin-1-ide;ethane;tungsten.
What is the SMILES notation for 1-tert-butylpiperazin-4-ide;1-tert-butylpiperidine;2-tert-butylpiperidin-1-ide;3-tert-butylpiperidin-1-ide;4-tert-butylpiperidin-1-ide;1-tert-butylpyrrolidine;2-tert-butylpyrrolidin-1-ide;3-tert-butylpyrrolidin-1-ide;ethane;tungsten?
The canonical SMILES for 1-tert-butylpiperazin-4-ide;1-tert-butylpiperidine;2-tert-butylpiperidin-1-ide;3-tert-butylpiperidin-1-ide;4-tert-butylpiperidin-1-ide;1-tert-butylpyrrolidine;2-tert-butylpyrrolidin-1-ide;3-tert-butylpyrrolidin-1-ide;ethane;tungsten is CC.CC.CC.CC.CC.CC.CC.CC.CC(C)(C)C1CCCC[N-]1.CC(C)(C)C1CCC[N-]1.CC(C)(C)C1CCC[N-]C1.CC(C)(C)C1CC[N-]C1.CC(C)(C)C1CC[N-]CC1.CC(C)(C)N1CCCC1.CC(C)(C)N1CCCCC1.CC(C)(C)N1CC[N-]CC1.[W].[W].[W].[W].[W].[W].
What is the InChIKey of 1-tert-butylpiperazin-4-ide;1-tert-butylpiperidine;2-tert-butylpiperidin-1-ide;3-tert-butylpiperidin-1-ide;4-tert-butylpiperidin-1-ide;1-tert-butylpyrrolidine;2-tert-butylpyrrolidin-1-ide;3-tert-butylpyrrolidin-1-ide;ethane;tungsten?
The InChIKey is YTHILAAOGBJRBX-UHFFFAOYSA-N. The full InChI is InChI=1S/2C9H18N.C9H19N.C9H18N.C8H17N2.C8H16N.C8H17N.C8H16N.8C2H6.6W/c1-9(2,3)8-4-6-10-7-5-8;1-9(2,3)8-5-4-6-10-7-8;1-9(2,3)10-7-5-4-6-8-10;1-9(2,3)8-6-4-5-7-10-8;1-8(2,3)10-6-4-9-5-7-10;1-8(2,3)7-4-5-9-6-7;1-8(2,3)9-6-4-5-7-9;1-8(2,3)7-5-4-6-9-7;8*1-2;;;;;;/h2*8H,4-7H2,1-3H3;4-8H2,1-3H3;8H,4-7H2,1-3H3;4-7H2,1-3H3;7H,4-6H2,1-3H3;4-7H2,1-3H3;7H,4-6H2,1-3H3;8*1-2H3;;;;;;/q2*-1;;3*-1;;-1;;;;;;;;;;;;;;.
What are the key properties of 1-tert-butylpiperazin-4-ide;1-tert-butylpiperidine;2-tert-butylpiperidin-1-ide;3-tert-butylpiperidin-1-ide;4-tert-butylpiperidin-1-ide;1-tert-butylpyrrolidine;2-tert-butylpyrrolidin-1-ide;3-tert-butylpyrrolidin-1-ide;ethane;tungsten?
1-tert-butylpiperazin-4-ide;1-tert-butylpiperidine;2-tert-butylpiperidin-1-ide;3-tert-butylpiperidin-1-ide;4-tert-butylpiperidin-1-ide;1-tert-butylpyrrolidine;2-tert-butylpyrrolidin-1-ide;3-tert-butylpyrrolidin-1-ide;ethane;tungsten has a molecular weight of 2426.52 g/mol, XLogP of 27.41, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-tert-butylpiperazin-4-ide;1-tert-butylpiperidine;2-tert-butylpiperidin-1-ide;3-tert-butylpiperidin-1-ide;4-tert-butylpiperidin-1-ide;1-tert-butylpyrrolidine;2-tert-butylpyrrolidin-1-ide;3-tert-butylpyrrolidin-1-ide;ethane;tungsten is sourced from PubChem (CID 157322500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).