2-tert-butyl-azanidacyclobutane;3-tert-butyl-azanidacyclobutane;2-tert-butyl-azanidacycloheptane;3-tert-butyl-azanidacycloheptane;2-tert-butyl-azanidacyclopropane;4-tert-butyl-1-methylazepane;3-tert-butyl-1-methylpiperidine;4-tert-butyl-1-methylpiperidine;3-tert-butyl-1-methylpyrrolidine;2-tert-butylpiperidin-1-ide;2-tert-butylpyrrolidin-1-ide;methane;tungsten

C104H226N11W7-7 — CID 157415236

IUPAC2-tert-butyl-azanidacyclobutane;3-tert-butyl-azanidacyclobutane;2-tert-butyl-azanidacycloheptane;3-tert-butyl-azanidacycloheptane;2-tert-butyl-azanidacyclopropane;4-tert-butyl-1-methylazepane;3-tert-butyl-1-methylpiperidine;4-tert-butyl-1-methylpiperidine;3-tert-butyl-1-methylpyrrolidine;2-tert-butylpiperidin-1-ide;2-tert-butylpyrrolidin-1-ide;methane;tungsten
SMILESC.C.C.C.C.C.C.CC(C)(C)C1CCCCC[N-]1.CC(C)(C)C1CCCC[N-]1.CC(C)(C)C1CCCC[N-]C1.CC(C)(C)C1CCC[N-]1.CC(C)(C)C1CC[N-]1.CC(C)(C)C1C[N-]1.CC(C)(C)C1C[N-]C1.CN1CCC(C(C)(C)C)C1.CN1CCC(C(C)(C)C)CC1.CN1CCCC(C(C)(C)C)C1.CN1CCCC(C(C)(C)C)CC1.[W].[W].[W].[W].[W].[W].[W]
InChIInChI=1S/C11H23N.2C10H21N.2C10H20N.C9H19N.C9H18N.C8H16N.2C7H14N.C6H12N.7CH4.7W/c1-11(2,3)10-6-5-8-12(4)9-7-10;1-10(2,3)9-5-7-11(4)8-6-9;1-10(2,3)9-6-5-7-11(4)8-9;1-10(2,3)9-6-4-5-7-11-8-9;1-10(2,3)9-7-5-4-6-8-11-9;1-9(2,3)8-5-6-10(4)7-8;1-9(2,3)8-6-4-5-7-10-8;1-8(2,3)7-5-4-6-9-7;1-7(2,3)6-4-8-5-6;1-7(2,3)6-4-5-8-6;1-6(2,3)5-4-7-5;;;;;;;;;;;;;;/h10H,5-9H2,1-4H3;2*9H,5-8H2,1-4H3;2*9H,4-8H2,1-3H3;8H,5-7H2,1-4H3;8H,4-7H2,1-3H3;7H,4-6H2,1-3H3;2*6H,4-5H2,1-3H3;5H,4H2,1-3H3;7*1H4;;;;;;;/q;;;2*-1;;5*-1;;;;;;;;;;;;;;
InChIKeyYAORGKRUJQRFLH-UHFFFAOYSA-N
MW2917.91 g/mol
LogP32.02
Rot. Bonds

About 2-tert-butyl-azanidacyclobutane;3-tert-butyl-azanidacyclobutane;2-tert-butyl-azanidacycloheptane;3-tert-butyl-azanidacycloheptane;2-tert-butyl-azanidacyclopropane;4-tert-butyl-1-methylazepane;3-tert-butyl-1-methylpiperidine;4-tert-butyl-1-methylpiperidine;3-tert-butyl-1-methylpyrrolidine;2-tert-butylpiperidin-1-ide;2-tert-butylpyrrolidin-1-ide;methane;tungsten

2-tert-butyl-azanidacyclobutane;3-tert-butyl-azanidacyclobutane;2-tert-butyl-azanidacycloheptane;3-tert-butyl-azanidacycloheptane;2-tert-butyl-azanidacyclopropane;4-tert-butyl-1-methylazepane;3-tert-butyl-1-methylpiperidine;4-tert-butyl-1-methylpiperidine;3-tert-butyl-1-methylpyrrolidine;2-tert-butylpiperidin-1-ide;2-tert-butylpyrrolidin-1-ide;methane;tungsten (PubChem CID 157415236) has the molecular formula C104H226N11W7-7 and a molecular weight of 2917.91 g/mol. Its IUPAC name is 2-tert-butyl-azanidacyclobutane;3-tert-butyl-azanidacyclobutane;2-tert-butyl-azanidacycloheptane;3-tert-butyl-azanidacycloheptane;2-tert-butyl-azanidacyclopropane;4-tert-butyl-1-methylazepane;3-tert-butyl-1-methylpiperidine;4-tert-butyl-1-methylpiperidine;3-tert-butyl-1-methylpyrrolidine;2-tert-butylpiperidin-1-ide;2-tert-butylpyrrolidin-1-ide;methane;tungsten.

Molecular Properties

Compound Name2-tert-butyl-azanidacyclobutane;3-tert-butyl-azanidacyclobutane;2-tert-butyl-azanidacycloheptane;3-tert-butyl-azanidacycloheptane;2-tert-butyl-azanidacyclopropane;4-tert-butyl-1-methylazepane;3-tert-butyl-1-methylpiperidine;4-tert-butyl-1-methylpiperidine;3-tert-butyl-1-methylpyrrolidine;2-tert-butylpiperidin-1-ide;2-tert-butylpyrrolidin-1-ide;methane;tungsten
PubChem CID157415236
Molecular FormulaC104H226N11W7-7
Molecular Weight2917.91 g/mol
Exact Mass2917.46
IUPAC Name2-tert-butyl-azanidacyclobutane;3-tert-butyl-azanidacyclobutane;2-tert-butyl-azanidacycloheptane;3-tert-butyl-azanidacycloheptane;2-tert-butyl-azanidacyclopropane;4-tert-butyl-1-methylazepane;3-tert-butyl-1-methylpiperidine;4-tert-butyl-1-methylpiperidine;3-tert-butyl-1-methylpyrrolidine;2-tert-butylpiperidin-1-ide;2-tert-butylpyrrolidin-1-ide;methane;tungsten
SMILESC.C.C.C.C.C.C.CC(C)(C)C1CCCCC[N-]1.CC(C)(C)C1CCCC[N-]1.CC(C)(C)C1CCCC[N-]C1.CC(C)(C)C1CCC[N-]1.CC(C)(C)C1CC[N-]1.CC(C)(C)C1C[N-]1.CC(C)(C)C1C[N-]C1.CN1CCC(C(C)(C)C)C1.CN1CCC(C(C)(C)C)CC1.CN1CCCC(C(C)(C)C)C1.CN1CCCC(C(C)(C)C)CC1.[W].[W].[W].[W].[W].[W].[W]
InChIInChI=1S/C11H23N.2C10H21N.2C10H20N.C9H19N.C9H18N.C8H16N.2C7H14N.C6H12N.7CH4.7W/c1-11(2,3)10-6-5-8-12(4)9-7-10;1-10(2,3)9-5-7-11(4)8-6-9;1-10(2,3)9-6-5-7-11(4)8-9;1-10(2,3)9-6-4-5-7-11-8-9;1-10(2,3)9-7-5-4-6-8-11-9;1-9(2,3)8-5-6-10(4)7-8;1-9(2,3)8-6-4-5-7-10-8;1-8(2,3)7-5-4-6-9-7;1-7(2,3)6-4-8-5-6;1-7(2,3)6-4-5-8-6;1-6(2,3)5-4-7-5;;;;;;;;;;;;;;/h10H,5-9H2,1-4H3;2*9H,5-8H2,1-4H3;2*9H,4-8H2,1-3H3;8H,5-7H2,1-4H3;8H,4-7H2,1-3H3;7H,4-6H2,1-3H3;2*6H,4-5H2,1-3H3;5H,4H2,1-3H3;7*1H4;;;;;;;/q;;;2*-1;;5*-1;;;;;;;;;;;;;;
InChIKeyYAORGKRUJQRFLH-UHFFFAOYSA-N
XLogP32.02
TPSA111.66 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms122
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002917.91
LogP ≤ 532.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

Analyze 2-tert-butyl-azanidacyclobutane;3-tert-butyl-azanidacyclobutane;2-tert-butyl-azanidacycloheptane;3-tert-butyl-azanidacycloheptane;2-tert-butyl-azanidacyclopropane;4-tert-butyl-1-methylazepane;3-tert-butyl-1-methylpiperidine;4-tert-butyl-1-methylpiperidine;3-tert-butyl-1-methylpyrrolidine;2-tert-butylpiperidin-1-ide;2-tert-butylpyrrolidin-1-ide;methane;tungsten with MolForge

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Related Compounds

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2-tert-butyl-4-fluoro-1-methylpiperidine;2-tert-butyl-5-fluoro-1-methylpiperidine;3-tert-butyl-1-methylpiperidine;4-tert-butyl-1-methylpiperidine
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2-tert-butyl-1-methylpiperidine;3-tert-butyl-1-methylpyrrolidine
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1-tert-butyl-4-methylpiperazine;4-tert-butyl-1-methylpiperidine;bis(1-tert-butylpiperidine);1-tert-butylpyrrolidine;methane
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tert-butylcyclopentadecane
CID 164774831
bis(tert-butylcyclohexane);bis(tert-butylcyclopentane);1-tert-butyl-4-methylpiperazine;4-tert-butyl-1-methylpiperidine;(2R)-2-tert-butyl-1-methylpyrrolidine;(2S)-2-tert-butyl-1-methylpyrrolidine;bis(1-tert-butylpiperidine);methane
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bis(tert-butylcyclohexane);1-(4-tert-butylpiperidin-1-yl)ethanone;methane
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2-(1-methylpyrrolidin-3-yl)propane-2-thiol
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Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-azanidacyclobutane;3-tert-butyl-azanidacyclobutane;2-tert-butyl-azanidacycloheptane;3-tert-butyl-azanidacycloheptane;2-tert-butyl-azanidacyclopropane;4-tert-butyl-1-methylazepane;3-tert-butyl-1-methylpiperidine;4-tert-butyl-1-methylpiperidine;3-tert-butyl-1-methylpyrrolidine;2-tert-butylpiperidin-1-ide;2-tert-butylpyrrolidin-1-ide;methane;tungsten?
The IUPAC name of 2-tert-butyl-azanidacyclobutane;3-tert-butyl-azanidacyclobutane;2-tert-butyl-azanidacycloheptane;3-tert-butyl-azanidacycloheptane;2-tert-butyl-azanidacyclopropane;4-tert-butyl-1-methylazepane;3-tert-butyl-1-methylpiperidine;4-tert-butyl-1-methylpiperidine;3-tert-butyl-1-methylpyrrolidine;2-tert-butylpiperidin-1-ide;2-tert-butylpyrrolidin-1-ide;methane;tungsten (CID 157415236) is 2-tert-butyl-azanidacyclobutane;3-tert-butyl-azanidacyclobutane;2-tert-butyl-azanidacycloheptane;3-tert-butyl-azanidacycloheptane;2-tert-butyl-azanidacyclopropane;4-tert-butyl-1-methylazepane;3-tert-butyl-1-methylpiperidine;4-tert-butyl-1-methylpiperidine;3-tert-butyl-1-methylpyrrolidine;2-tert-butylpiperidin-1-ide;2-tert-butylpyrrolidin-1-ide;methane;tungsten.
What is the SMILES notation for 2-tert-butyl-azanidacyclobutane;3-tert-butyl-azanidacyclobutane;2-tert-butyl-azanidacycloheptane;3-tert-butyl-azanidacycloheptane;2-tert-butyl-azanidacyclopropane;4-tert-butyl-1-methylazepane;3-tert-butyl-1-methylpiperidine;4-tert-butyl-1-methylpiperidine;3-tert-butyl-1-methylpyrrolidine;2-tert-butylpiperidin-1-ide;2-tert-butylpyrrolidin-1-ide;methane;tungsten?
The canonical SMILES for 2-tert-butyl-azanidacyclobutane;3-tert-butyl-azanidacyclobutane;2-tert-butyl-azanidacycloheptane;3-tert-butyl-azanidacycloheptane;2-tert-butyl-azanidacyclopropane;4-tert-butyl-1-methylazepane;3-tert-butyl-1-methylpiperidine;4-tert-butyl-1-methylpiperidine;3-tert-butyl-1-methylpyrrolidine;2-tert-butylpiperidin-1-ide;2-tert-butylpyrrolidin-1-ide;methane;tungsten is C.C.C.C.C.C.C.CC(C)(C)C1CCCCC[N-]1.CC(C)(C)C1CCCC[N-]1.CC(C)(C)C1CCCC[N-]C1.CC(C)(C)C1CCC[N-]1.CC(C)(C)C1CC[N-]1.CC(C)(C)C1C[N-]1.CC(C)(C)C1C[N-]C1.CN1CCC(C(C)(C)C)C1.CN1CCC(C(C)(C)C)CC1.CN1CCCC(C(C)(C)C)C1.CN1CCCC(C(C)(C)C)CC1.[W].[W].[W].[W].[W].[W].[W].
What is the InChIKey of 2-tert-butyl-azanidacyclobutane;3-tert-butyl-azanidacyclobutane;2-tert-butyl-azanidacycloheptane;3-tert-butyl-azanidacycloheptane;2-tert-butyl-azanidacyclopropane;4-tert-butyl-1-methylazepane;3-tert-butyl-1-methylpiperidine;4-tert-butyl-1-methylpiperidine;3-tert-butyl-1-methylpyrrolidine;2-tert-butylpiperidin-1-ide;2-tert-butylpyrrolidin-1-ide;methane;tungsten?
The InChIKey is YAORGKRUJQRFLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N.2C10H21N.2C10H20N.C9H19N.C9H18N.C8H16N.2C7H14N.C6H12N.7CH4.7W/c1-11(2,3)10-6-5-8-12(4)9-7-10;1-10(2,3)9-5-7-11(4)8-6-9;1-10(2,3)9-6-5-7-11(4)8-9;1-10(2,3)9-6-4-5-7-11-8-9;1-10(2,3)9-7-5-4-6-8-11-9;1-9(2,3)8-5-6-10(4)7-8;1-9(2,3)8-6-4-5-7-10-8;1-8(2,3)7-5-4-6-9-7;1-7(2,3)6-4-8-5-6;1-7(2,3)6-4-5-8-6;1-6(2,3)5-4-7-5;;;;;;;;;;;;;;/h10H,5-9H2,1-4H3;2*9H,5-8H2,1-4H3;2*9H,4-8H2,1-3H3;8H,5-7H2,1-4H3;8H,4-7H2,1-3H3;7H,4-6H2,1-3H3;2*6H,4-5H2,1-3H3;5H,4H2,1-3H3;7*1H4;;;;;;;/q;;;2*-1;;5*-1;;;;;;;;;;;;;;.
What are the key properties of 2-tert-butyl-azanidacyclobutane;3-tert-butyl-azanidacyclobutane;2-tert-butyl-azanidacycloheptane;3-tert-butyl-azanidacycloheptane;2-tert-butyl-azanidacyclopropane;4-tert-butyl-1-methylazepane;3-tert-butyl-1-methylpiperidine;4-tert-butyl-1-methylpiperidine;3-tert-butyl-1-methylpyrrolidine;2-tert-butylpiperidin-1-ide;2-tert-butylpyrrolidin-1-ide;methane;tungsten?
2-tert-butyl-azanidacyclobutane;3-tert-butyl-azanidacyclobutane;2-tert-butyl-azanidacycloheptane;3-tert-butyl-azanidacycloheptane;2-tert-butyl-azanidacyclopropane;4-tert-butyl-1-methylazepane;3-tert-butyl-1-methylpiperidine;4-tert-butyl-1-methylpiperidine;3-tert-butyl-1-methylpyrrolidine;2-tert-butylpiperidin-1-ide;2-tert-butylpyrrolidin-1-ide;methane;tungsten has a molecular weight of 2917.91 g/mol, XLogP of 32.02, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-azanidacyclobutane;3-tert-butyl-azanidacyclobutane;2-tert-butyl-azanidacycloheptane;3-tert-butyl-azanidacycloheptane;2-tert-butyl-azanidacyclopropane;4-tert-butyl-1-methylazepane;3-tert-butyl-1-methylpiperidine;4-tert-butyl-1-methylpiperidine;3-tert-butyl-1-methylpyrrolidine;2-tert-butylpiperidin-1-ide;2-tert-butylpyrrolidin-1-ide;methane;tungsten is sourced from PubChem (CID 157415236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).