3-tert-butyl-1-methylazetidine;3-tert-butyl-1-methylpyrrolidine;3,3-dimethylbutylcyclohexane;4-(3,3-dimethylbutyl)-2,6-dimethylmorpholine;1-(3,3-dimethylbutyl)-4-methylpiperazine;1-(3,3-dimethylbutyl)-3-methylpiperidine;2-(3,3-dimethylbutyl)-1-methylpyrrolidine;1-(4,4-dimethylpentyl)-4-methylpiperazine;1-(4,4-dimethylpentyl)piperidine;2,2-dimethylpropylcyclohexane;2-(2,2-dimethylpropyl)-1-methylpiperidine;methane;N,N,2,3,3-pentamethylbutan-1-amine;1-(2,2,3,3-tetramethylbutyl)piperidine;N,N,2,2-tetramethylpropan-1-amine;1-(2,4,4-trimethylpentan-2-yl)piperidine

C174H389N15O — CID 158048610

About 3-tert-butyl-1-methylazetidine;3-tert-butyl-1-methylpyrrolidine;3,3-dimethylbutylcyclohexane;4-(3,3-dimethylbutyl)-2,6-dimethylmorpholine;1-(3,3-dimethylbutyl)-4-methylpiperazine;1-(3,3-dimethylbutyl)-3-methylpiperidine;2-(3,3-dimethylbutyl)-1-methylpyrrolidine;1-(4,4-dimethylpentyl)-4-methylpiperazine;1-(4,4-dimethylpentyl)piperidine;2,2-dimethylpropylcyclohexane;2-(2,2-dimethylpropyl)-1-methylpiperidine;methane;N,N,2,3,3-pentamethylbutan-1-amine;1-(2,2,3,3-tetramethylbutyl)piperidine;N,N,2,2-tetramethylpropan-1-amine;1-(2,4,4-trimethylpentan-2-yl)piperidine

3-tert-butyl-1-methylazetidine;3-tert-butyl-1-methylpyrrolidine;3,3-dimethylbutylcyclohexane;4-(3,3-dimethylbutyl)-2,6-dimethylmorpholine;1-(3,3-dimethylbutyl)-4-methylpiperazine;1-(3,3-dimethylbutyl)-3-methylpiperidine;2-(3,3-dimethylbutyl)-1-methylpyrrolidine;1-(4,4-dimethylpentyl)-4-methylpiperazine;1-(4,4-dimethylpentyl)piperidine;2,2-dimethylpropylcyclohexane;2-(2,2-dimethylpropyl)-1-methylpiperidine;methane;N,N,2,3,3-pentamethylbutan-1-amine;1-(2,2,3,3-tetramethylbutyl)piperidine;N,N,2,2-tetramethylpropan-1-amine;1-(2,4,4-trimethylpentan-2-yl)piperidine (PubChem CID 158048610) has the molecular formula C174H389N15O and a molecular weight of 2708.13 g/mol. Its IUPAC name is 3-tert-butyl-1-methylazetidine;3-tert-butyl-1-methylpyrrolidine;3,3-dimethylbutylcyclohexane;4-(3,3-dimethylbutyl)-2,6-dimethylmorpholine;1-(3,3-dimethylbutyl)-4-methylpiperazine;1-(3,3-dimethylbutyl)-3-methylpiperidine;2-(3,3-dimethylbutyl)-1-methylpyrrolidine;1-(4,4-dimethylpentyl)-4-methylpiperazine;1-(4,4-dimethylpentyl)piperidine;2,2-dimethylpropylcyclohexane;2-(2,2-dimethylpropyl)-1-methylpiperidine;methane;N,N,2,3,3-pentamethylbutan-1-amine;1-(2,2,3,3-tetramethylbutyl)piperidine;N,N,2,2-tetramethylpropan-1-amine;1-(2,4,4-trimethylpentan-2-yl)piperidine.

Molecular Properties

• Compound Name: 3-tert-butyl-1-methylazetidine;3-tert-butyl-1-methylpyrrolidine;3,3-dimethylbutylcyclohexane;4-(3,3-dimethylbutyl)-2,6-dimethylmorpholine;1-(3,3-dimethylbutyl)-4-methylpiperazine;1-(3,3-dimethylbutyl)-3-methylpiperidine;2-(3,3-dimethylbutyl)-1-methylpyrrolidine;1-(4,4-dimethylpentyl)-4-methylpiperazine;1-(4,4-dimethylpentyl)piperidine;2,2-dimethylpropylcyclohexane;2-(2,2-dimethylpropyl)-1-methylpiperidine;methane;N,N,2,3,3-pentamethylbutan-1-amine;1-(2,2,3,3-tetramethylbutyl)piperidine;N,N,2,2-tetramethylpropan-1-amine;1-(2,4,4-trimethylpentan-2-yl)piperidine
• PubChem CID: 158048610
• Molecular Formula: C174H389N15O
• Molecular Weight: 2708.13 g/mol
• Exact Mass: 2706.08
• IUPAC Name: 3-tert-butyl-1-methylazetidine;3-tert-butyl-1-methylpyrrolidine;3,3-dimethylbutylcyclohexane;4-(3,3-dimethylbutyl)-2,6-dimethylmorpholine;1-(3,3-dimethylbutyl)-4-methylpiperazine;1-(3,3-dimethylbutyl)-3-methylpiperidine;2-(3,3-dimethylbutyl)-1-methylpyrrolidine;1-(4,4-dimethylpentyl)-4-methylpiperazine;1-(4,4-dimethylpentyl)piperidine;2,2-dimethylpropylcyclohexane;2-(2,2-dimethylpropyl)-1-methylpiperidine;methane;N,N,2,3,3-pentamethylbutan-1-amine;1-(2,2,3,3-tetramethylbutyl)piperidine;N,N,2,2-tetramethylpropan-1-amine;1-(2,4,4-trimethylpentan-2-yl)piperidine
• SMILES: C.C.C.C.C.C.C.C.C.C.C.CC(C)(C)C(C)(C)CN1CCCCC1.CC(C)(C)CC(C)(C)N1CCCCC1.CC(C)(C)CC1CCCCC1.CC(C)(C)CCC1CCCCC1.CC(C)(C)CCCN1CCCCC1.CC(CN(C)C)C(C)(C)C.CC1CCCN(CCC(C)(C)C)C1.CC1CN(CCC(C)(C)C)CC(C)O1.CN(C)CC(C)(C)C.CN1CC(C(C)(C)C)C1.CN1CCC(C(C)(C)C)C1.CN1CCCC1CCC(C)(C)C.CN1CCCCC1CC(C)(C)C.CN1CCN(CCC(C)(C)C)CC1.CN1CCN(CCCC(C)(C)C)CC1
• InChI: InChI=1S/2C13H27N.C12H26N2.C12H25NO.2C12H25N.C12H24.C11H24N2.2C11H23N.C11H22.C9H19N.C9H21N.C8H17N.C7H17N.11CH4/c1-12(2,3)13(4,5)11-14-9-7-6-8-10-14;1-12(2,3)11-13(4,5)14-9-7-6-8-10-14;1-12(2,3)6-5-7-14-10-8-13(4)9-11-14;1-10-8-13(9-11(2)14-10)7-6-12(3,4)5;1-11-6-5-8-13(10-11)9-7-12(2,3)4;1-12(2,3)8-7-11-13-9-5-4-6-10-13;1-12(2,3)10-9-11-7-5-4-6-8-11;1-11(2,3)5-6-13-9-7-12(4)8-10-13;1-11(2,3)8-7-10-6-5-9-12(10)4;1-11(2,3)9-10-7-5-6-8-12(10)4;1-11(2,3)9-10-7-5-4-6-8-10;1-9(2,3)8-5-6-10(4)7-8;1-8(7-10(5)6)9(2,3)4;1-8(2,3)7-5-9(4)6-7;1-7(2,3)6-8(4)5;;;;;;;;;;;/h2*6-11H2,1-5H3;5-11H2,1-4H3;10-11H,6-9H2,1-5H3;11H,5-10H2,1-4H3;4-11H2,1-3H3;11H,4-10H2,1-3H3;5-10H2,1-4H3;2*10H,5-9H2,1-4H3;10H,4-9H2,1-3H3;8H,5-7H2,1-4H3;8H,7H2,1-6H3;7H,5-6H2,1-4H3;6H2,1-5H3;11*1H4
• InChIKey: FJFCAIAULVEYAL-UHFFFAOYSA-N
• XLogP: 48.56
• TPSA: 57.83 Ų
• H-Bond Acceptors: 16
• Rotatable Bonds: 25
• Heavy Atoms: 190
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2708.13
LogP ≤ 5	48.56
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	16

Frequently Asked Questions

What is the IUPAC name of 3-tert-butyl-1-methylazetidine;3-tert-butyl-1-methylpyrrolidine;3,3-dimethylbutylcyclohexane;4-(3,3-dimethylbutyl)-2,6-dimethylmorpholine;1-(3,3-dimethylbutyl)-4-methylpiperazine;1-(3,3-dimethylbutyl)-3-methylpiperidine;2-(3,3-dimethylbutyl)-1-methylpyrrolidine;1-(4,4-dimethylpentyl)-4-methylpiperazine;1-(4,4-dimethylpentyl)piperidine;2,2-dimethylpropylcyclohexane;2-(2,2-dimethylpropyl)-1-methylpiperidine;methane;N,N,2,3,3-pentamethylbutan-1-amine;1-(2,2,3,3-tetramethylbutyl)piperidine;N,N,2,2-tetramethylpropan-1-amine;1-(2,4,4-trimethylpentan-2-yl)piperidine?

The IUPAC name of 3-tert-butyl-1-methylazetidine;3-tert-butyl-1-methylpyrrolidine;3,3-dimethylbutylcyclohexane;4-(3,3-dimethylbutyl)-2,6-dimethylmorpholine;1-(3,3-dimethylbutyl)-4-methylpiperazine;1-(3,3-dimethylbutyl)-3-methylpiperidine;2-(3,3-dimethylbutyl)-1-methylpyrrolidine;1-(4,4-dimethylpentyl)-4-methylpiperazine;1-(4,4-dimethylpentyl)piperidine;2,2-dimethylpropylcyclohexane;2-(2,2-dimethylpropyl)-1-methylpiperidine;methane;N,N,2,3,3-pentamethylbutan-1-amine;1-(2,2,3,3-tetramethylbutyl)piperidine;N,N,2,2-tetramethylpropan-1-amine;1-(2,4,4-trimethylpentan-2-yl)piperidine (CID 158048610) is 3-tert-butyl-1-methylazetidine;3-tert-butyl-1-methylpyrrolidine;3,3-dimethylbutylcyclohexane;4-(3,3-dimethylbutyl)-2,6-dimethylmorpholine;1-(3,3-dimethylbutyl)-4-methylpiperazine;1-(3,3-dimethylbutyl)-3-methylpiperidine;2-(3,3-dimethylbutyl)-1-methylpyrrolidine;1-(4,4-dimethylpentyl)-4-methylpiperazine;1-(4,4-dimethylpentyl)piperidine;2,2-dimethylpropylcyclohexane;2-(2,2-dimethylpropyl)-1-methylpiperidine;methane;N,N,2,3,3-pentamethylbutan-1-amine;1-(2,2,3,3-tetramethylbutyl)piperidine;N,N,2,2-tetramethylpropan-1-amine;1-(2,4,4-trimethylpentan-2-yl)piperidine.

What is the SMILES notation for 3-tert-butyl-1-methylazetidine;3-tert-butyl-1-methylpyrrolidine;3,3-dimethylbutylcyclohexane;4-(3,3-dimethylbutyl)-2,6-dimethylmorpholine;1-(3,3-dimethylbutyl)-4-methylpiperazine;1-(3,3-dimethylbutyl)-3-methylpiperidine;2-(3,3-dimethylbutyl)-1-methylpyrrolidine;1-(4,4-dimethylpentyl)-4-methylpiperazine;1-(4,4-dimethylpentyl)piperidine;2,2-dimethylpropylcyclohexane;2-(2,2-dimethylpropyl)-1-methylpiperidine;methane;N,N,2,3,3-pentamethylbutan-1-amine;1-(2,2,3,3-tetramethylbutyl)piperidine;N,N,2,2-tetramethylpropan-1-amine;1-(2,4,4-trimethylpentan-2-yl)piperidine?

The canonical SMILES for 3-tert-butyl-1-methylazetidine;3-tert-butyl-1-methylpyrrolidine;3,3-dimethylbutylcyclohexane;4-(3,3-dimethylbutyl)-2,6-dimethylmorpholine;1-(3,3-dimethylbutyl)-4-methylpiperazine;1-(3,3-dimethylbutyl)-3-methylpiperidine;2-(3,3-dimethylbutyl)-1-methylpyrrolidine;1-(4,4-dimethylpentyl)-4-methylpiperazine;1-(4,4-dimethylpentyl)piperidine;2,2-dimethylpropylcyclohexane;2-(2,2-dimethylpropyl)-1-methylpiperidine;methane;N,N,2,3,3-pentamethylbutan-1-amine;1-(2,2,3,3-tetramethylbutyl)piperidine;N,N,2,2-tetramethylpropan-1-amine;1-(2,4,4-trimethylpentan-2-yl)piperidine is C.C.C.C.C.C.C.C.C.C.C.CC(C)(C)C(C)(C)CN1CCCCC1.CC(C)(C)CC(C)(C)N1CCCCC1.CC(C)(C)CC1CCCCC1.CC(C)(C)CCC1CCCCC1.CC(C)(C)CCCN1CCCCC1.CC(CN(C)C)C(C)(C)C.CC1CCCN(CCC(C)(C)C)C1.CC1CN(CCC(C)(C)C)CC(C)O1.CN(C)CC(C)(C)C.CN1CC(C(C)(C)C)C1.CN1CCC(C(C)(C)C)C1.CN1CCCC1CCC(C)(C)C.CN1CCCCC1CC(C)(C)C.CN1CCN(CCC(C)(C)C)CC1.CN1CCN(CCCC(C)(C)C)CC1.

What is the InChIKey of 3-tert-butyl-1-methylazetidine;3-tert-butyl-1-methylpyrrolidine;3,3-dimethylbutylcyclohexane;4-(3,3-dimethylbutyl)-2,6-dimethylmorpholine;1-(3,3-dimethylbutyl)-4-methylpiperazine;1-(3,3-dimethylbutyl)-3-methylpiperidine;2-(3,3-dimethylbutyl)-1-methylpyrrolidine;1-(4,4-dimethylpentyl)-4-methylpiperazine;1-(4,4-dimethylpentyl)piperidine;2,2-dimethylpropylcyclohexane;2-(2,2-dimethylpropyl)-1-methylpiperidine;methane;N,N,2,3,3-pentamethylbutan-1-amine;1-(2,2,3,3-tetramethylbutyl)piperidine;N,N,2,2-tetramethylpropan-1-amine;1-(2,4,4-trimethylpentan-2-yl)piperidine?

The InChIKey is FJFCAIAULVEYAL-UHFFFAOYSA-N. The full InChI is InChI=1S/2C13H27N.C12H26N2.C12H25NO.2C12H25N.C12H24.C11H24N2.2C11H23N.C11H22.C9H19N.C9H21N.C8H17N.C7H17N.11CH4/c1-12(2,3)13(4,5)11-14-9-7-6-8-10-14;1-12(2,3)11-13(4,5)14-9-7-6-8-10-14;1-12(2,3)6-5-7-14-10-8-13(4)9-11-14;1-10-8-13(9-11(2)14-10)7-6-12(3,4)5;1-11-6-5-8-13(10-11)9-7-12(2,3)4;1-12(2,3)8-7-11-13-9-5-4-6-10-13;1-12(2,3)10-9-11-7-5-4-6-8-11;1-11(2,3)5-6-13-9-7-12(4)8-10-13;1-11(2,3)8-7-10-6-5-9-12(10)4;1-11(2,3)9-10-7-5-6-8-12(10)4;1-11(2,3)9-10-7-5-4-6-8-10;1-9(2,3)8-5-6-10(4)7-8;1-8(7-10(5)6)9(2,3)4;1-8(2,3)7-5-9(4)6-7;1-7(2,3)6-8(4)5;;;;;;;;;;;/h2*6-11H2,1-5H3;5-11H2,1-4H3;10-11H,6-9H2,1-5H3;11H,5-10H2,1-4H3;4-11H2,1-3H3;11H,4-10H2,1-3H3;5-10H2,1-4H3;2*10H,5-9H2,1-4H3;10H,4-9H2,1-3H3;8H,5-7H2,1-4H3;8H,7H2,1-6H3;7H,5-6H2,1-4H3;6H2,1-5H3;11*1H4.

What are the key properties of 3-tert-butyl-1-methylazetidine;3-tert-butyl-1-methylpyrrolidine;3,3-dimethylbutylcyclohexane;4-(3,3-dimethylbutyl)-2,6-dimethylmorpholine;1-(3,3-dimethylbutyl)-4-methylpiperazine;1-(3,3-dimethylbutyl)-3-methylpiperidine;2-(3,3-dimethylbutyl)-1-methylpyrrolidine;1-(4,4-dimethylpentyl)-4-methylpiperazine;1-(4,4-dimethylpentyl)piperidine;2,2-dimethylpropylcyclohexane;2-(2,2-dimethylpropyl)-1-methylpiperidine;methane;N,N,2,3,3-pentamethylbutan-1-amine;1-(2,2,3,3-tetramethylbutyl)piperidine;N,N,2,2-tetramethylpropan-1-amine;1-(2,4,4-trimethylpentan-2-yl)piperidine?

3-tert-butyl-1-methylazetidine;3-tert-butyl-1-methylpyrrolidine;3,3-dimethylbutylcyclohexane;4-(3,3-dimethylbutyl)-2,6-dimethylmorpholine;1-(3,3-dimethylbutyl)-4-methylpiperazine;1-(3,3-dimethylbutyl)-3-methylpiperidine;2-(3,3-dimethylbutyl)-1-methylpyrrolidine;1-(4,4-dimethylpentyl)-4-methylpiperazine;1-(4,4-dimethylpentyl)piperidine;2,2-dimethylpropylcyclohexane;2-(2,2-dimethylpropyl)-1-methylpiperidine;methane;N,N,2,3,3-pentamethylbutan-1-amine;1-(2,2,3,3-tetramethylbutyl)piperidine;N,N,2,2-tetramethylpropan-1-amine;1-(2,4,4-trimethylpentan-2-yl)piperidine has a molecular weight of 2708.13 g/mol, XLogP of 48.56, 25 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.

Where does this data come from?

All data for 3-tert-butyl-1-methylazetidine;3-tert-butyl-1-methylpyrrolidine;3,3-dimethylbutylcyclohexane;4-(3,3-dimethylbutyl)-2,6-dimethylmorpholine;1-(3,3-dimethylbutyl)-4-methylpiperazine;1-(3,3-dimethylbutyl)-3-methylpiperidine;2-(3,3-dimethylbutyl)-1-methylpyrrolidine;1-(4,4-dimethylpentyl)-4-methylpiperazine;1-(4,4-dimethylpentyl)piperidine;2,2-dimethylpropylcyclohexane;2-(2,2-dimethylpropyl)-1-methylpiperidine;methane;N,N,2,3,3-pentamethylbutan-1-amine;1-(2,2,3,3-tetramethylbutyl)piperidine;N,N,2,2-tetramethylpropan-1-amine;1-(2,4,4-trimethylpentan-2-yl)piperidine is sourced from PubChem (CID 158048610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).