1-tert-butyl-3,5-dimethylpiperazine;(3S,5R)-1-tert-butyl-3,5-dimethylpiperazine;1-tert-butyl-2,6-dimethylpiperidine;(2R,6S)-1-tert-butyl-2,6-dimethylpiperidine;bis(1-tert-butyl-4-ethylpiperazine);1-tert-butyl-4-methylpiperazine;1-tert-butyl-4-propan-2-ylpiperazine;(2R,6S)-4-tert-butyl-1,2,6-trimethylpiperazine;4-tert-butyl-1,2,6-trimethylpiperazine;methane

C105H230N18 — CID 159644311

About 1-tert-butyl-3,5-dimethylpiperazine;(3S,5R)-1-tert-butyl-3,5-dimethylpiperazine;1-tert-butyl-2,6-dimethylpiperidine;(2R,6S)-1-tert-butyl-2,6-dimethylpiperidine;bis(1-tert-butyl-4-ethylpiperazine);1-tert-butyl-4-methylpiperazine;1-tert-butyl-4-propan-2-ylpiperazine;(2R,6S)-4-tert-butyl-1,2,6-trimethylpiperazine;4-tert-butyl-1,2,6-trimethylpiperazine;methane

1-tert-butyl-3,5-dimethylpiperazine;(3S,5R)-1-tert-butyl-3,5-dimethylpiperazine;1-tert-butyl-2,6-dimethylpiperidine;(2R,6S)-1-tert-butyl-2,6-dimethylpiperidine;bis(1-tert-butyl-4-ethylpiperazine);1-tert-butyl-4-methylpiperazine;1-tert-butyl-4-propan-2-ylpiperazine;(2R,6S)-4-tert-butyl-1,2,6-trimethylpiperazine;4-tert-butyl-1,2,6-trimethylpiperazine;methane (PubChem CID 159644311) has the molecular formula C105H230N18 and a molecular weight of 1745.12 g/mol. Its IUPAC name is 1-tert-butyl-3,5-dimethylpiperazine;(3S,5R)-1-tert-butyl-3,5-dimethylpiperazine;1-tert-butyl-2,6-dimethylpiperidine;(2R,6S)-1-tert-butyl-2,6-dimethylpiperidine;bis(1-tert-butyl-4-ethylpiperazine);1-tert-butyl-4-methylpiperazine;1-tert-butyl-4-propan-2-ylpiperazine;(2R,6S)-4-tert-butyl-1,2,6-trimethylpiperazine;4-tert-butyl-1,2,6-trimethylpiperazine;methane.

Molecular Properties

• Compound Name: 1-tert-butyl-3,5-dimethylpiperazine;(3S,5R)-1-tert-butyl-3,5-dimethylpiperazine;1-tert-butyl-2,6-dimethylpiperidine;(2R,6S)-1-tert-butyl-2,6-dimethylpiperidine;bis(1-tert-butyl-4-ethylpiperazine);1-tert-butyl-4-methylpiperazine;1-tert-butyl-4-propan-2-ylpiperazine;(2R,6S)-4-tert-butyl-1,2,6-trimethylpiperazine;4-tert-butyl-1,2,6-trimethylpiperazine;methane
• PubChem CID: 159644311
• Molecular Formula: C105H230N18
• Molecular Weight: 1745.12 g/mol
• Exact Mass: 1743.86
• IUPAC Name: 1-tert-butyl-3,5-dimethylpiperazine;(3S,5R)-1-tert-butyl-3,5-dimethylpiperazine;1-tert-butyl-2,6-dimethylpiperidine;(2R,6S)-1-tert-butyl-2,6-dimethylpiperidine;bis(1-tert-butyl-4-ethylpiperazine);1-tert-butyl-4-methylpiperazine;1-tert-butyl-4-propan-2-ylpiperazine;(2R,6S)-4-tert-butyl-1,2,6-trimethylpiperazine;4-tert-butyl-1,2,6-trimethylpiperazine;methane
• SMILES: C.CC(C)N1CCN(C(C)(C)C)CC1.CC1CCCC(C)N1C(C)(C)C.CC1CN(C(C)(C)C)CC(C)N1.CC1CN(C(C)(C)C)CC(C)N1C.CCN1CCN(C(C)(C)C)CC1.CCN1CCN(C(C)(C)C)CC1.CN1CCN(C(C)(C)C)CC1.C[C@@H]1CCC[C@H](C)N1C(C)(C)C.C[C@@H]1CN(C(C)(C)C)C[C@H](C)N1.C[C@@H]1CN(C(C)(C)C)C[C@H](C)N1C
• InChI: InChI=1S/3C11H24N2.2C11H23N.4C10H22N2.C9H20N2.CH4/c2*1-9-7-13(11(3,4)5)8-10(2)12(9)6;1-10(2)12-6-8-13(9-7-12)11(3,4)5;2*1-9-7-6-8-10(2)12(9)11(3,4)5;2*1-8-6-12(10(3,4)5)7-9(2)11-8;2*1-5-11-6-8-12(9-7-11)10(2,3)4;1-9(2,3)11-7-5-10(4)6-8-11;/h2*9-10H,7-8H2,1-6H3;10H,6-9H2,1-5H3;2*9-10H,6-8H2,1-5H3;2*8-9,11H,6-7H2,1-5H3;2*5-9H2,1-4H3;5-8H2,1-4H3;1H4/t9-,10+;;;9-,10+;;8-,9+
• InChIKey: MQTJTPNDEHRJKU-AUDLIDTLSA-N
• XLogP: 18.97
• TPSA: 75.90 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 18
• Rotatable Bonds: 3
• Heavy Atoms: 123
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1745.12
LogP ≤ 5	18.97
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	18

Frequently Asked Questions

What is the IUPAC name of 1-tert-butyl-3,5-dimethylpiperazine;(3S,5R)-1-tert-butyl-3,5-dimethylpiperazine;1-tert-butyl-2,6-dimethylpiperidine;(2R,6S)-1-tert-butyl-2,6-dimethylpiperidine;bis(1-tert-butyl-4-ethylpiperazine);1-tert-butyl-4-methylpiperazine;1-tert-butyl-4-propan-2-ylpiperazine;(2R,6S)-4-tert-butyl-1,2,6-trimethylpiperazine;4-tert-butyl-1,2,6-trimethylpiperazine;methane?

The IUPAC name of 1-tert-butyl-3,5-dimethylpiperazine;(3S,5R)-1-tert-butyl-3,5-dimethylpiperazine;1-tert-butyl-2,6-dimethylpiperidine;(2R,6S)-1-tert-butyl-2,6-dimethylpiperidine;bis(1-tert-butyl-4-ethylpiperazine);1-tert-butyl-4-methylpiperazine;1-tert-butyl-4-propan-2-ylpiperazine;(2R,6S)-4-tert-butyl-1,2,6-trimethylpiperazine;4-tert-butyl-1,2,6-trimethylpiperazine;methane (CID 159644311) is 1-tert-butyl-3,5-dimethylpiperazine;(3S,5R)-1-tert-butyl-3,5-dimethylpiperazine;1-tert-butyl-2,6-dimethylpiperidine;(2R,6S)-1-tert-butyl-2,6-dimethylpiperidine;bis(1-tert-butyl-4-ethylpiperazine);1-tert-butyl-4-methylpiperazine;1-tert-butyl-4-propan-2-ylpiperazine;(2R,6S)-4-tert-butyl-1,2,6-trimethylpiperazine;4-tert-butyl-1,2,6-trimethylpiperazine;methane.

What is the SMILES notation for 1-tert-butyl-3,5-dimethylpiperazine;(3S,5R)-1-tert-butyl-3,5-dimethylpiperazine;1-tert-butyl-2,6-dimethylpiperidine;(2R,6S)-1-tert-butyl-2,6-dimethylpiperidine;bis(1-tert-butyl-4-ethylpiperazine);1-tert-butyl-4-methylpiperazine;1-tert-butyl-4-propan-2-ylpiperazine;(2R,6S)-4-tert-butyl-1,2,6-trimethylpiperazine;4-tert-butyl-1,2,6-trimethylpiperazine;methane?

The canonical SMILES for 1-tert-butyl-3,5-dimethylpiperazine;(3S,5R)-1-tert-butyl-3,5-dimethylpiperazine;1-tert-butyl-2,6-dimethylpiperidine;(2R,6S)-1-tert-butyl-2,6-dimethylpiperidine;bis(1-tert-butyl-4-ethylpiperazine);1-tert-butyl-4-methylpiperazine;1-tert-butyl-4-propan-2-ylpiperazine;(2R,6S)-4-tert-butyl-1,2,6-trimethylpiperazine;4-tert-butyl-1,2,6-trimethylpiperazine;methane is C.CC(C)N1CCN(C(C)(C)C)CC1.CC1CCCC(C)N1C(C)(C)C.CC1CN(C(C)(C)C)CC(C)N1.CC1CN(C(C)(C)C)CC(C)N1C.CCN1CCN(C(C)(C)C)CC1.CCN1CCN(C(C)(C)C)CC1.CN1CCN(C(C)(C)C)CC1.C[C@@H]1CCC[C@H](C)N1C(C)(C)C.C[C@@H]1CN(C(C)(C)C)C[C@H](C)N1.C[C@@H]1CN(C(C)(C)C)C[C@H](C)N1C.

What is the InChIKey of 1-tert-butyl-3,5-dimethylpiperazine;(3S,5R)-1-tert-butyl-3,5-dimethylpiperazine;1-tert-butyl-2,6-dimethylpiperidine;(2R,6S)-1-tert-butyl-2,6-dimethylpiperidine;bis(1-tert-butyl-4-ethylpiperazine);1-tert-butyl-4-methylpiperazine;1-tert-butyl-4-propan-2-ylpiperazine;(2R,6S)-4-tert-butyl-1,2,6-trimethylpiperazine;4-tert-butyl-1,2,6-trimethylpiperazine;methane?

The InChIKey is MQTJTPNDEHRJKU-AUDLIDTLSA-N. The full InChI is InChI=1S/3C11H24N2.2C11H23N.4C10H22N2.C9H20N2.CH4/c2*1-9-7-13(11(3,4)5)8-10(2)12(9)6;1-10(2)12-6-8-13(9-7-12)11(3,4)5;2*1-9-7-6-8-10(2)12(9)11(3,4)5;2*1-8-6-12(10(3,4)5)7-9(2)11-8;2*1-5-11-6-8-12(9-7-11)10(2,3)4;1-9(2,3)11-7-5-10(4)6-8-11;/h2*9-10H,7-8H2,1-6H3;10H,6-9H2,1-5H3;2*9-10H,6-8H2,1-5H3;2*8-9,11H,6-7H2,1-5H3;2*5-9H2,1-4H3;5-8H2,1-4H3;1H4/t9-,10+;;;9-,10+;;8-,9+;;;;;.

What are the key properties of 1-tert-butyl-3,5-dimethylpiperazine;(3S,5R)-1-tert-butyl-3,5-dimethylpiperazine;1-tert-butyl-2,6-dimethylpiperidine;(2R,6S)-1-tert-butyl-2,6-dimethylpiperidine;bis(1-tert-butyl-4-ethylpiperazine);1-tert-butyl-4-methylpiperazine;1-tert-butyl-4-propan-2-ylpiperazine;(2R,6S)-4-tert-butyl-1,2,6-trimethylpiperazine;4-tert-butyl-1,2,6-trimethylpiperazine;methane?

1-tert-butyl-3,5-dimethylpiperazine;(3S,5R)-1-tert-butyl-3,5-dimethylpiperazine;1-tert-butyl-2,6-dimethylpiperidine;(2R,6S)-1-tert-butyl-2,6-dimethylpiperidine;bis(1-tert-butyl-4-ethylpiperazine);1-tert-butyl-4-methylpiperazine;1-tert-butyl-4-propan-2-ylpiperazine;(2R,6S)-4-tert-butyl-1,2,6-trimethylpiperazine;4-tert-butyl-1,2,6-trimethylpiperazine;methane has a molecular weight of 1745.12 g/mol, XLogP of 18.97, 3 rotatable bonds, 2 hydrogen bond donors, and 18 hydrogen bond acceptors.

Where does this data come from?

All data for 1-tert-butyl-3,5-dimethylpiperazine;(3S,5R)-1-tert-butyl-3,5-dimethylpiperazine;1-tert-butyl-2,6-dimethylpiperidine;(2R,6S)-1-tert-butyl-2,6-dimethylpiperidine;bis(1-tert-butyl-4-ethylpiperazine);1-tert-butyl-4-methylpiperazine;1-tert-butyl-4-propan-2-ylpiperazine;(2R,6S)-4-tert-butyl-1,2,6-trimethylpiperazine;4-tert-butyl-1,2,6-trimethylpiperazine;methane is sourced from PubChem (CID 159644311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).