N-butyl-1-tert-butylpiperidin-4-amine;1-tert-butyl-N-ethylpiperidin-4-amine;3-tert-butyl-1-heptylazetidine;bis(1-tert-butyl-4-methylpiperidine);3-tert-butyl-1-octylazetidine;1-tert-butyl-N-pentylpiperidin-4-amine;1-tert-butyl-N-propylpiperidin-4-amine

C99H210N12 — CID 167541723

About N-butyl-1-tert-butylpiperidin-4-amine;1-tert-butyl-N-ethylpiperidin-4-amine;3-tert-butyl-1-heptylazetidine;bis(1-tert-butyl-4-methylpiperidine);3-tert-butyl-1-octylazetidine;1-tert-butyl-N-pentylpiperidin-4-amine;1-tert-butyl-N-propylpiperidin-4-amine

N-butyl-1-tert-butylpiperidin-4-amine;1-tert-butyl-N-ethylpiperidin-4-amine;3-tert-butyl-1-heptylazetidine;bis(1-tert-butyl-4-methylpiperidine);3-tert-butyl-1-octylazetidine;1-tert-butyl-N-pentylpiperidin-4-amine;1-tert-butyl-N-propylpiperidin-4-amine (PubChem CID 167541723) has the molecular formula C99H210N12 and a molecular weight of 1568.85 g/mol. Its IUPAC name is N-butyl-1-tert-butylpiperidin-4-amine;1-tert-butyl-N-ethylpiperidin-4-amine;3-tert-butyl-1-heptylazetidine;bis(1-tert-butyl-4-methylpiperidine);3-tert-butyl-1-octylazetidine;1-tert-butyl-N-pentylpiperidin-4-amine;1-tert-butyl-N-propylpiperidin-4-amine.

Molecular Properties

• Compound Name: N-butyl-1-tert-butylpiperidin-4-amine;1-tert-butyl-N-ethylpiperidin-4-amine;3-tert-butyl-1-heptylazetidine;bis(1-tert-butyl-4-methylpiperidine);3-tert-butyl-1-octylazetidine;1-tert-butyl-N-pentylpiperidin-4-amine;1-tert-butyl-N-propylpiperidin-4-amine
• PubChem CID: 167541723
• Molecular Formula: C99H210N12
• Molecular Weight: 1568.85 g/mol
• Exact Mass: 1567.68
• IUPAC Name: N-butyl-1-tert-butylpiperidin-4-amine;1-tert-butyl-N-ethylpiperidin-4-amine;3-tert-butyl-1-heptylazetidine;bis(1-tert-butyl-4-methylpiperidine);3-tert-butyl-1-octylazetidine;1-tert-butyl-N-pentylpiperidin-4-amine;1-tert-butyl-N-propylpiperidin-4-amine
• SMILES: CC1CCN(C(C)(C)C)CC1.CC1CCN(C(C)(C)C)CC1.CCCCCCCCN1CC(C(C)(C)C)C1.CCCCCCCN1CC(C(C)(C)C)C1.CCCCCNC1CCN(C(C)(C)C)CC1.CCCCNC1CCN(C(C)(C)C)CC1.CCCNC1CCN(C(C)(C)C)CC1.CCNC1CCN(C(C)(C)C)CC1
• InChI: InChI=1S/C15H31N.C14H30N2.C14H29N.C13H28N2.C12H26N2.C11H24N2.2C10H21N/c1-5-6-7-8-9-10-11-16-12-14(13-16)15(2,3)4;1-5-6-7-10-15-13-8-11-16(12-9-13)14(2,3)4;1-5-6-7-8-9-10-15-11-13(12-15)14(2,3)4;1-5-6-9-14-12-7-10-15(11-8-12)13(2,3)4;1-5-8-13-11-6-9-14(10-7-11)12(2,3)4;1-5-12-10-6-8-13(9-7-10)11(2,3)4;2*1-9-5-7-11(8-6-9)10(2,3)4/h14H,5-13H2,1-4H3;13,15H,5-12H2,1-4H3;13H,5-12H2,1-4H3;12,14H,5-11H2,1-4H3;11,13H,5-10H2,1-4H3;10,12H,5-9H2,1-4H3;2*9H,5-8H2,1-4H3
• InChIKey: BGWSCUYAPVZBSN-UHFFFAOYSA-N
• XLogP: 23.07
• TPSA: 74.04 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 12
• Rotatable Bonds: 27
• Heavy Atoms: 111
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1568.85
LogP ≤ 5	23.07
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	12

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-butyl-1-tert-butylpiperidin-4-amine;1-tert-butyl-N-ethylpiperidin-4-amine;3-tert-butyl-1-heptylazetidine;bis(1-tert-butyl-4-methylpiperidine);3-tert-butyl-1-octylazetidine;1-tert-butyl-N-pentylpiperidin-4-amine;1-tert-butyl-N-propylpiperidin-4-amine?

The IUPAC name of N-butyl-1-tert-butylpiperidin-4-amine;1-tert-butyl-N-ethylpiperidin-4-amine;3-tert-butyl-1-heptylazetidine;bis(1-tert-butyl-4-methylpiperidine);3-tert-butyl-1-octylazetidine;1-tert-butyl-N-pentylpiperidin-4-amine;1-tert-butyl-N-propylpiperidin-4-amine (CID 167541723) is N-butyl-1-tert-butylpiperidin-4-amine;1-tert-butyl-N-ethylpiperidin-4-amine;3-tert-butyl-1-heptylazetidine;bis(1-tert-butyl-4-methylpiperidine);3-tert-butyl-1-octylazetidine;1-tert-butyl-N-pentylpiperidin-4-amine;1-tert-butyl-N-propylpiperidin-4-amine.

What is the SMILES notation for N-butyl-1-tert-butylpiperidin-4-amine;1-tert-butyl-N-ethylpiperidin-4-amine;3-tert-butyl-1-heptylazetidine;bis(1-tert-butyl-4-methylpiperidine);3-tert-butyl-1-octylazetidine;1-tert-butyl-N-pentylpiperidin-4-amine;1-tert-butyl-N-propylpiperidin-4-amine?

The canonical SMILES for N-butyl-1-tert-butylpiperidin-4-amine;1-tert-butyl-N-ethylpiperidin-4-amine;3-tert-butyl-1-heptylazetidine;bis(1-tert-butyl-4-methylpiperidine);3-tert-butyl-1-octylazetidine;1-tert-butyl-N-pentylpiperidin-4-amine;1-tert-butyl-N-propylpiperidin-4-amine is CC1CCN(C(C)(C)C)CC1.CC1CCN(C(C)(C)C)CC1.CCCCCCCCN1CC(C(C)(C)C)C1.CCCCCCCN1CC(C(C)(C)C)C1.CCCCCNC1CCN(C(C)(C)C)CC1.CCCCNC1CCN(C(C)(C)C)CC1.CCCNC1CCN(C(C)(C)C)CC1.CCNC1CCN(C(C)(C)C)CC1.

What is the InChIKey of N-butyl-1-tert-butylpiperidin-4-amine;1-tert-butyl-N-ethylpiperidin-4-amine;3-tert-butyl-1-heptylazetidine;bis(1-tert-butyl-4-methylpiperidine);3-tert-butyl-1-octylazetidine;1-tert-butyl-N-pentylpiperidin-4-amine;1-tert-butyl-N-propylpiperidin-4-amine?

The InChIKey is BGWSCUYAPVZBSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N.C14H30N2.C14H29N.C13H28N2.C12H26N2.C11H24N2.2C10H21N/c1-5-6-7-8-9-10-11-16-12-14(13-16)15(2,3)4;1-5-6-7-10-15-13-8-11-16(12-9-13)14(2,3)4;1-5-6-7-8-9-10-15-11-13(12-15)14(2,3)4;1-5-6-9-14-12-7-10-15(11-8-12)13(2,3)4;1-5-8-13-11-6-9-14(10-7-11)12(2,3)4;1-5-12-10-6-8-13(9-7-10)11(2,3)4;2*1-9-5-7-11(8-6-9)10(2,3)4/h14H,5-13H2,1-4H3;13,15H,5-12H2,1-4H3;13H,5-12H2,1-4H3;12,14H,5-11H2,1-4H3;11,13H,5-10H2,1-4H3;10,12H,5-9H2,1-4H3;2*9H,5-8H2,1-4H3.

What are the key properties of N-butyl-1-tert-butylpiperidin-4-amine;1-tert-butyl-N-ethylpiperidin-4-amine;3-tert-butyl-1-heptylazetidine;bis(1-tert-butyl-4-methylpiperidine);3-tert-butyl-1-octylazetidine;1-tert-butyl-N-pentylpiperidin-4-amine;1-tert-butyl-N-propylpiperidin-4-amine?

N-butyl-1-tert-butylpiperidin-4-amine;1-tert-butyl-N-ethylpiperidin-4-amine;3-tert-butyl-1-heptylazetidine;bis(1-tert-butyl-4-methylpiperidine);3-tert-butyl-1-octylazetidine;1-tert-butyl-N-pentylpiperidin-4-amine;1-tert-butyl-N-propylpiperidin-4-amine has a molecular weight of 1568.85 g/mol, XLogP of 23.07, 27 rotatable bonds, 4 hydrogen bond donors, and 12 hydrogen bond acceptors.

Where does this data come from?

All data for N-butyl-1-tert-butylpiperidin-4-amine;1-tert-butyl-N-ethylpiperidin-4-amine;3-tert-butyl-1-heptylazetidine;bis(1-tert-butyl-4-methylpiperidine);3-tert-butyl-1-octylazetidine;1-tert-butyl-N-pentylpiperidin-4-amine;1-tert-butyl-N-propylpiperidin-4-amine is sourced from PubChem (CID 167541723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).