methane;4-methyl-1-(2-methylpropyl)-4-propan-2-ylpiperidine;3-(2-methylpropyl)-6-propan-2-yl-3-azabicyclo[3.1.0]hexane;8-(2-methylpropyl)-3-propan-2-yl-8-azabicyclo[3.2.1]octane;1-(2-methylpropyl)-3-propan-2-ylazetidine;1-(2-methylpropyl)-4-propan-2-ylpiperidine;1-(2-methylpropyl)-3-propan-2-ylpyrrolidine

C79H174N6 — CID 162073835

About methane;4-methyl-1-(2-methylpropyl)-4-propan-2-ylpiperidine;3-(2-methylpropyl)-6-propan-2-yl-3-azabicyclo[3.1.0]hexane;8-(2-methylpropyl)-3-propan-2-yl-8-azabicyclo[3.2.1]octane;1-(2-methylpropyl)-3-propan-2-ylazetidine;1-(2-methylpropyl)-4-propan-2-ylpiperidine;1-(2-methylpropyl)-3-propan-2-ylpyrrolidine

methane;4-methyl-1-(2-methylpropyl)-4-propan-2-ylpiperidine;3-(2-methylpropyl)-6-propan-2-yl-3-azabicyclo[3.1.0]hexane;8-(2-methylpropyl)-3-propan-2-yl-8-azabicyclo[3.2.1]octane;1-(2-methylpropyl)-3-propan-2-ylazetidine;1-(2-methylpropyl)-4-propan-2-ylpiperidine;1-(2-methylpropyl)-3-propan-2-ylpyrrolidine (PubChem CID 162073835) has the molecular formula C79H174N6 and a molecular weight of 1208.30 g/mol. Its IUPAC name is methane;4-methyl-1-(2-methylpropyl)-4-propan-2-ylpiperidine;3-(2-methylpropyl)-6-propan-2-yl-3-azabicyclo[3.1.0]hexane;8-(2-methylpropyl)-3-propan-2-yl-8-azabicyclo[3.2.1]octane;1-(2-methylpropyl)-3-propan-2-ylazetidine;1-(2-methylpropyl)-4-propan-2-ylpiperidine;1-(2-methylpropyl)-3-propan-2-ylpyrrolidine.

Molecular Properties

• Compound Name: methane;4-methyl-1-(2-methylpropyl)-4-propan-2-ylpiperidine;3-(2-methylpropyl)-6-propan-2-yl-3-azabicyclo[3.1.0]hexane;8-(2-methylpropyl)-3-propan-2-yl-8-azabicyclo[3.2.1]octane;1-(2-methylpropyl)-3-propan-2-ylazetidine;1-(2-methylpropyl)-4-propan-2-ylpiperidine;1-(2-methylpropyl)-3-propan-2-ylpyrrolidine
• PubChem CID: 162073835
• Molecular Formula: C79H174N6
• Molecular Weight: 1208.30 g/mol
• Exact Mass: 1207.38
• IUPAC Name: methane;4-methyl-1-(2-methylpropyl)-4-propan-2-ylpiperidine;3-(2-methylpropyl)-6-propan-2-yl-3-azabicyclo[3.1.0]hexane;8-(2-methylpropyl)-3-propan-2-yl-8-azabicyclo[3.2.1]octane;1-(2-methylpropyl)-3-propan-2-ylazetidine;1-(2-methylpropyl)-4-propan-2-ylpiperidine;1-(2-methylpropyl)-3-propan-2-ylpyrrolidine
• SMILES: C.C.C.C.C.C.C.CC(C)CN1C2CCC1CC(C(C)C)C2.CC(C)CN1CC(C(C)C)C1.CC(C)CN1CC2C(C1)C2C(C)C.CC(C)CN1CCC(C(C)C)C1.CC(C)CN1CCC(C(C)C)CC1.CC(C)CN1CCC(C)(C(C)C)CC1
• InChI: InChI=1S/C14H27N.C13H27N.C12H23N.C12H25N.C11H23N.C10H21N.7CH4/c1-10(2)9-15-13-5-6-14(15)8-12(7-13)11(3)4;1-11(2)10-14-8-6-13(5,7-9-14)12(3)4;1-8(2)5-13-6-10-11(7-13)12(10)9(3)4;1-10(2)9-13-7-5-12(6-8-13)11(3)4;1-9(2)7-12-6-5-11(8-12)10(3)4;1-8(2)5-11-6-10(7-11)9(3)4;;;;;;;/h10-14H,5-9H2,1-4H3;11-12H,6-10H2,1-5H3;8-12H,5-7H2,1-4H3;10-12H,5-9H2,1-4H3;9-11H,5-8H2,1-4H3;8-10H,5-7H2,1-4H3;7*1H4
• InChIKey: ZBLHIBXMWAIJLB-UHFFFAOYSA-N
• XLogP: 21.73
• TPSA: 19.44 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 18
• Heavy Atoms: 85
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1208.30
LogP ≤ 5	21.73
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of methane;4-methyl-1-(2-methylpropyl)-4-propan-2-ylpiperidine;3-(2-methylpropyl)-6-propan-2-yl-3-azabicyclo[3.1.0]hexane;8-(2-methylpropyl)-3-propan-2-yl-8-azabicyclo[3.2.1]octane;1-(2-methylpropyl)-3-propan-2-ylazetidine;1-(2-methylpropyl)-4-propan-2-ylpiperidine;1-(2-methylpropyl)-3-propan-2-ylpyrrolidine?

The IUPAC name of methane;4-methyl-1-(2-methylpropyl)-4-propan-2-ylpiperidine;3-(2-methylpropyl)-6-propan-2-yl-3-azabicyclo[3.1.0]hexane;8-(2-methylpropyl)-3-propan-2-yl-8-azabicyclo[3.2.1]octane;1-(2-methylpropyl)-3-propan-2-ylazetidine;1-(2-methylpropyl)-4-propan-2-ylpiperidine;1-(2-methylpropyl)-3-propan-2-ylpyrrolidine (CID 162073835) is methane;4-methyl-1-(2-methylpropyl)-4-propan-2-ylpiperidine;3-(2-methylpropyl)-6-propan-2-yl-3-azabicyclo[3.1.0]hexane;8-(2-methylpropyl)-3-propan-2-yl-8-azabicyclo[3.2.1]octane;1-(2-methylpropyl)-3-propan-2-ylazetidine;1-(2-methylpropyl)-4-propan-2-ylpiperidine;1-(2-methylpropyl)-3-propan-2-ylpyrrolidine.

What is the SMILES notation for methane;4-methyl-1-(2-methylpropyl)-4-propan-2-ylpiperidine;3-(2-methylpropyl)-6-propan-2-yl-3-azabicyclo[3.1.0]hexane;8-(2-methylpropyl)-3-propan-2-yl-8-azabicyclo[3.2.1]octane;1-(2-methylpropyl)-3-propan-2-ylazetidine;1-(2-methylpropyl)-4-propan-2-ylpiperidine;1-(2-methylpropyl)-3-propan-2-ylpyrrolidine?

The canonical SMILES for methane;4-methyl-1-(2-methylpropyl)-4-propan-2-ylpiperidine;3-(2-methylpropyl)-6-propan-2-yl-3-azabicyclo[3.1.0]hexane;8-(2-methylpropyl)-3-propan-2-yl-8-azabicyclo[3.2.1]octane;1-(2-methylpropyl)-3-propan-2-ylazetidine;1-(2-methylpropyl)-4-propan-2-ylpiperidine;1-(2-methylpropyl)-3-propan-2-ylpyrrolidine is C.C.C.C.C.C.C.CC(C)CN1C2CCC1CC(C(C)C)C2.CC(C)CN1CC(C(C)C)C1.CC(C)CN1CC2C(C1)C2C(C)C.CC(C)CN1CCC(C(C)C)C1.CC(C)CN1CCC(C(C)C)CC1.CC(C)CN1CCC(C)(C(C)C)CC1.

What is the InChIKey of methane;4-methyl-1-(2-methylpropyl)-4-propan-2-ylpiperidine;3-(2-methylpropyl)-6-propan-2-yl-3-azabicyclo[3.1.0]hexane;8-(2-methylpropyl)-3-propan-2-yl-8-azabicyclo[3.2.1]octane;1-(2-methylpropyl)-3-propan-2-ylazetidine;1-(2-methylpropyl)-4-propan-2-ylpiperidine;1-(2-methylpropyl)-3-propan-2-ylpyrrolidine?

The InChIKey is ZBLHIBXMWAIJLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N.C13H27N.C12H23N.C12H25N.C11H23N.C10H21N.7CH4/c1-10(2)9-15-13-5-6-14(15)8-12(7-13)11(3)4;1-11(2)10-14-8-6-13(5,7-9-14)12(3)4;1-8(2)5-13-6-10-11(7-13)12(10)9(3)4;1-10(2)9-13-7-5-12(6-8-13)11(3)4;1-9(2)7-12-6-5-11(8-12)10(3)4;1-8(2)5-11-6-10(7-11)9(3)4;;;;;;;/h10-14H,5-9H2,1-4H3;11-12H,6-10H2,1-5H3;8-12H,5-7H2,1-4H3;10-12H,5-9H2,1-4H3;9-11H,5-8H2,1-4H3;8-10H,5-7H2,1-4H3;7*1H4.

What are the key properties of methane;4-methyl-1-(2-methylpropyl)-4-propan-2-ylpiperidine;3-(2-methylpropyl)-6-propan-2-yl-3-azabicyclo[3.1.0]hexane;8-(2-methylpropyl)-3-propan-2-yl-8-azabicyclo[3.2.1]octane;1-(2-methylpropyl)-3-propan-2-ylazetidine;1-(2-methylpropyl)-4-propan-2-ylpiperidine;1-(2-methylpropyl)-3-propan-2-ylpyrrolidine?

methane;4-methyl-1-(2-methylpropyl)-4-propan-2-ylpiperidine;3-(2-methylpropyl)-6-propan-2-yl-3-azabicyclo[3.1.0]hexane;8-(2-methylpropyl)-3-propan-2-yl-8-azabicyclo[3.2.1]octane;1-(2-methylpropyl)-3-propan-2-ylazetidine;1-(2-methylpropyl)-4-propan-2-ylpiperidine;1-(2-methylpropyl)-3-propan-2-ylpyrrolidine has a molecular weight of 1208.30 g/mol, XLogP of 21.73, 18 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for methane;4-methyl-1-(2-methylpropyl)-4-propan-2-ylpiperidine;3-(2-methylpropyl)-6-propan-2-yl-3-azabicyclo[3.1.0]hexane;8-(2-methylpropyl)-3-propan-2-yl-8-azabicyclo[3.2.1]octane;1-(2-methylpropyl)-3-propan-2-ylazetidine;1-(2-methylpropyl)-4-propan-2-ylpiperidine;1-(2-methylpropyl)-3-propan-2-ylpyrrolidine is sourced from PubChem (CID 162073835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).