(2R)-1,2-dimethyl-4-propan-2-ylpiperazine;(2S)-1,2-dimethyl-4-propan-2-ylpiperazine;(3R)-N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;(3R)-N-ethyl-N-methyl-1-propan-2-ylpyrrolidin-3-amine;(3R)-N-(2-methoxyethyl)-N-methyl-1-propan-2-ylpyrrolidin-3-amine;1-methyl-4-propan-2-ylpiperazine;(2S,6S)-1,2,6-trimethyl-4-propan-2-ylpiperazine;(2R,6R)-1,2,6-trimethyl-4-propan-2-ylpiperazine;bis((2S,6R)-1,2,6-trimethyl-4-propan-2-ylpiperazine)

C96H212N20O — CID 159280460

IUPAC(2R)-1,2-dimethyl-4-propan-2-ylpiperazine;(2S)-1,2-dimethyl-4-propan-2-ylpiperazine;(3R)-N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;(3R)-N-ethyl-N-methyl-1-propan-2-ylpyrrolidin-3-amine;(3R)-N-(2-methoxyethyl)-N-methyl-1-propan-2-ylpyrrolidin-3-amine;1-methyl-4-propan-2-ylpiperazine;(2S,6S)-1,2,6-trimethyl-4-propan-2-ylpiperazine;(2R,6R)-1,2,6-trimethyl-4-propan-2-ylpiperazine;bis((2S,6R)-1,2,6-trimethyl-4-propan-2-ylpiperazine)
SMILESCC(C)N1CCN(C)CC1.CC(C)N1CCN(C)[C@@H](C)C1.CC(C)N1CCN(C)[C@H](C)C1.CC(C)N1CC[C@@H](N(C)C)C1.CC(C)N1C[C@@H](C)N(C)[C@@H](C)C1.CC(C)N1C[C@@H](C)N(C)[C@@H](C)C1.CC(C)N1C[C@@H](C)N(C)[C@H](C)C1.CC(C)N1C[C@H](C)N(C)[C@@H](C)C1.CCN(C)[C@@H]1CCN(C(C)C)C1.COCCN(C)[C@@H]1CCN(C(C)C)C1
InChIInChI=1S/C11H24N2O.5C10H22N2.3C9H20N2.C8H18N2/c1-10(2)13-6-5-11(9-13)12(3)7-8-14-4;4*1-8(2)12-6-9(3)11(5)10(4)7-12;1-5-11(4)10-6-7-12(8-10)9(2)3;1-8(2)11-6-5-9(7-11)10(3)4;2*1-8(2)11-6-5-10(4)9(3)7-11;1-8(2)10-6-4-9(3)5-7-10/h10-11H,5-9H2,1-4H3;4*8-10H,6-7H2,1-5H3;9-10H,5-8H2,1-4H3;3*8-9H,5-7H2,1-4H3;8H,4-7H2,1-3H3/t11-;2*9-,10+;2*9-,10-;10-;3*9-;/m1..101110./s1
InChIKeyKYVRFDFOUFSJOZ-UZVDSSQQSA-N
MW1662.89 g/mol
LogP11.88
Rot. Bonds17

About (2R)-1,2-dimethyl-4-propan-2-ylpiperazine;(2S)-1,2-dimethyl-4-propan-2-ylpiperazine;(3R)-N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;(3R)-N-ethyl-N-methyl-1-propan-2-ylpyrrolidin-3-amine;(3R)-N-(2-methoxyethyl)-N-methyl-1-propan-2-ylpyrrolidin-3-amine;1-methyl-4-propan-2-ylpiperazine;(2S,6S)-1,2,6-trimethyl-4-propan-2-ylpiperazine;(2R,6R)-1,2,6-trimethyl-4-propan-2-ylpiperazine;bis((2S,6R)-1,2,6-trimethyl-4-propan-2-ylpiperazine)

(2R)-1,2-dimethyl-4-propan-2-ylpiperazine;(2S)-1,2-dimethyl-4-propan-2-ylpiperazine;(3R)-N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;(3R)-N-ethyl-N-methyl-1-propan-2-ylpyrrolidin-3-amine;(3R)-N-(2-methoxyethyl)-N-methyl-1-propan-2-ylpyrrolidin-3-amine;1-methyl-4-propan-2-ylpiperazine;(2S,6S)-1,2,6-trimethyl-4-propan-2-ylpiperazine;(2R,6R)-1,2,6-trimethyl-4-propan-2-ylpiperazine;bis((2S,6R)-1,2,6-trimethyl-4-propan-2-ylpiperazine) (PubChem CID 159280460) has the molecular formula C96H212N20O and a molecular weight of 1662.89 g/mol. Its IUPAC name is (2R)-1,2-dimethyl-4-propan-2-ylpiperazine;(2S)-1,2-dimethyl-4-propan-2-ylpiperazine;(3R)-N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;(3R)-N-ethyl-N-methyl-1-propan-2-ylpyrrolidin-3-amine;(3R)-N-(2-methoxyethyl)-N-methyl-1-propan-2-ylpyrrolidin-3-amine;1-methyl-4-propan-2-ylpiperazine;(2S,6S)-1,2,6-trimethyl-4-propan-2-ylpiperazine;(2R,6R)-1,2,6-trimethyl-4-propan-2-ylpiperazine;bis((2S,6R)-1,2,6-trimethyl-4-propan-2-ylpiperazine).

Molecular Properties

Compound Name(2R)-1,2-dimethyl-4-propan-2-ylpiperazine;(2S)-1,2-dimethyl-4-propan-2-ylpiperazine;(3R)-N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;(3R)-N-ethyl-N-methyl-1-propan-2-ylpyrrolidin-3-amine;(3R)-N-(2-methoxyethyl)-N-methyl-1-propan-2-ylpyrrolidin-3-amine;1-methyl-4-propan-2-ylpiperazine;(2S,6S)-1,2,6-trimethyl-4-propan-2-ylpiperazine;(2R,6R)-1,2,6-trimethyl-4-propan-2-ylpiperazine;bis((2S,6R)-1,2,6-trimethyl-4-propan-2-ylpiperazine)
PubChem CID159280460
Molecular FormulaC96H212N20O
Molecular Weight1662.89 g/mol
Exact Mass1661.72
IUPAC Name(2R)-1,2-dimethyl-4-propan-2-ylpiperazine;(2S)-1,2-dimethyl-4-propan-2-ylpiperazine;(3R)-N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;(3R)-N-ethyl-N-methyl-1-propan-2-ylpyrrolidin-3-amine;(3R)-N-(2-methoxyethyl)-N-methyl-1-propan-2-ylpyrrolidin-3-amine;1-methyl-4-propan-2-ylpiperazine;(2S,6S)-1,2,6-trimethyl-4-propan-2-ylpiperazine;(2R,6R)-1,2,6-trimethyl-4-propan-2-ylpiperazine;bis((2S,6R)-1,2,6-trimethyl-4-propan-2-ylpiperazine)
SMILESCC(C)N1CCN(C)CC1.CC(C)N1CCN(C)[C@@H](C)C1.CC(C)N1CCN(C)[C@H](C)C1.CC(C)N1CC[C@@H](N(C)C)C1.CC(C)N1C[C@@H](C)N(C)[C@@H](C)C1.CC(C)N1C[C@@H](C)N(C)[C@@H](C)C1.CC(C)N1C[C@@H](C)N(C)[C@H](C)C1.CC(C)N1C[C@H](C)N(C)[C@@H](C)C1.CCN(C)[C@@H]1CCN(C(C)C)C1.COCCN(C)[C@@H]1CCN(C(C)C)C1
InChIInChI=1S/C11H24N2O.5C10H22N2.3C9H20N2.C8H18N2/c1-10(2)13-6-5-11(9-13)12(3)7-8-14-4;4*1-8(2)12-6-9(3)11(5)10(4)7-12;1-5-11(4)10-6-7-12(8-10)9(2)3;1-8(2)11-6-5-9(7-11)10(3)4;2*1-8(2)11-6-5-10(4)9(3)7-11;1-8(2)10-6-4-9(3)5-7-10/h10-11H,5-9H2,1-4H3;4*8-10H,6-7H2,1-5H3;9-10H,5-8H2,1-4H3;3*8-9H,5-7H2,1-4H3;8H,4-7H2,1-3H3/t11-;2*9-,10+;2*9-,10-;10-;3*9-;/m1..101110./s1
InChIKeyKYVRFDFOUFSJOZ-UZVDSSQQSA-N
XLogP11.88
TPSA74.03 Ų
H-Bond Donors
H-Bond Acceptors21
Rotatable Bonds17
Heavy Atoms117
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001662.89
LogP ≤ 511.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1021

Analyze (2R)-1,2-dimethyl-4-propan-2-ylpiperazine;(2S)-1,2-dimethyl-4-propan-2-ylpiperazine;(3R)-N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;(3R)-N-ethyl-N-methyl-1-propan-2-ylpyrrolidin-3-amine;(3R)-N-(2-methoxyethyl)-N-methyl-1-propan-2-ylpyrrolidin-3-amine;1-methyl-4-propan-2-ylpiperazine;(2S,6S)-1,2,6-trimethyl-4-propan-2-ylpiperazine;(2R,6R)-1,2,6-trimethyl-4-propan-2-ylpiperazine;bis((2S,6R)-1,2,6-trimethyl-4-propan-2-ylpiperazine) with MolForge

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Frequently Asked Questions

What is the IUPAC name of (2R)-1,2-dimethyl-4-propan-2-ylpiperazine;(2S)-1,2-dimethyl-4-propan-2-ylpiperazine;(3R)-N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;(3R)-N-ethyl-N-methyl-1-propan-2-ylpyrrolidin-3-amine;(3R)-N-(2-methoxyethyl)-N-methyl-1-propan-2-ylpyrrolidin-3-amine;1-methyl-4-propan-2-ylpiperazine;(2S,6S)-1,2,6-trimethyl-4-propan-2-ylpiperazine;(2R,6R)-1,2,6-trimethyl-4-propan-2-ylpiperazine;bis((2S,6R)-1,2,6-trimethyl-4-propan-2-ylpiperazine)?
The IUPAC name of (2R)-1,2-dimethyl-4-propan-2-ylpiperazine;(2S)-1,2-dimethyl-4-propan-2-ylpiperazine;(3R)-N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;(3R)-N-ethyl-N-methyl-1-propan-2-ylpyrrolidin-3-amine;(3R)-N-(2-methoxyethyl)-N-methyl-1-propan-2-ylpyrrolidin-3-amine;1-methyl-4-propan-2-ylpiperazine;(2S,6S)-1,2,6-trimethyl-4-propan-2-ylpiperazine;(2R,6R)-1,2,6-trimethyl-4-propan-2-ylpiperazine;bis((2S,6R)-1,2,6-trimethyl-4-propan-2-ylpiperazine) (CID 159280460) is (2R)-1,2-dimethyl-4-propan-2-ylpiperazine;(2S)-1,2-dimethyl-4-propan-2-ylpiperazine;(3R)-N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;(3R)-N-ethyl-N-methyl-1-propan-2-ylpyrrolidin-3-amine;(3R)-N-(2-methoxyethyl)-N-methyl-1-propan-2-ylpyrrolidin-3-amine;1-methyl-4-propan-2-ylpiperazine;(2S,6S)-1,2,6-trimethyl-4-propan-2-ylpiperazine;(2R,6R)-1,2,6-trimethyl-4-propan-2-ylpiperazine;bis((2S,6R)-1,2,6-trimethyl-4-propan-2-ylpiperazine).
What is the SMILES notation for (2R)-1,2-dimethyl-4-propan-2-ylpiperazine;(2S)-1,2-dimethyl-4-propan-2-ylpiperazine;(3R)-N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;(3R)-N-ethyl-N-methyl-1-propan-2-ylpyrrolidin-3-amine;(3R)-N-(2-methoxyethyl)-N-methyl-1-propan-2-ylpyrrolidin-3-amine;1-methyl-4-propan-2-ylpiperazine;(2S,6S)-1,2,6-trimethyl-4-propan-2-ylpiperazine;(2R,6R)-1,2,6-trimethyl-4-propan-2-ylpiperazine;bis((2S,6R)-1,2,6-trimethyl-4-propan-2-ylpiperazine)?
The canonical SMILES for (2R)-1,2-dimethyl-4-propan-2-ylpiperazine;(2S)-1,2-dimethyl-4-propan-2-ylpiperazine;(3R)-N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;(3R)-N-ethyl-N-methyl-1-propan-2-ylpyrrolidin-3-amine;(3R)-N-(2-methoxyethyl)-N-methyl-1-propan-2-ylpyrrolidin-3-amine;1-methyl-4-propan-2-ylpiperazine;(2S,6S)-1,2,6-trimethyl-4-propan-2-ylpiperazine;(2R,6R)-1,2,6-trimethyl-4-propan-2-ylpiperazine;bis((2S,6R)-1,2,6-trimethyl-4-propan-2-ylpiperazine) is CC(C)N1CCN(C)CC1.CC(C)N1CCN(C)[C@@H](C)C1.CC(C)N1CCN(C)[C@H](C)C1.CC(C)N1CC[C@@H](N(C)C)C1.CC(C)N1C[C@@H](C)N(C)[C@@H](C)C1.CC(C)N1C[C@@H](C)N(C)[C@@H](C)C1.CC(C)N1C[C@@H](C)N(C)[C@H](C)C1.CC(C)N1C[C@H](C)N(C)[C@@H](C)C1.CCN(C)[C@@H]1CCN(C(C)C)C1.COCCN(C)[C@@H]1CCN(C(C)C)C1.
What is the InChIKey of (2R)-1,2-dimethyl-4-propan-2-ylpiperazine;(2S)-1,2-dimethyl-4-propan-2-ylpiperazine;(3R)-N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;(3R)-N-ethyl-N-methyl-1-propan-2-ylpyrrolidin-3-amine;(3R)-N-(2-methoxyethyl)-N-methyl-1-propan-2-ylpyrrolidin-3-amine;1-methyl-4-propan-2-ylpiperazine;(2S,6S)-1,2,6-trimethyl-4-propan-2-ylpiperazine;(2R,6R)-1,2,6-trimethyl-4-propan-2-ylpiperazine;bis((2S,6R)-1,2,6-trimethyl-4-propan-2-ylpiperazine)?
The InChIKey is KYVRFDFOUFSJOZ-UZVDSSQQSA-N. The full InChI is InChI=1S/C11H24N2O.5C10H22N2.3C9H20N2.C8H18N2/c1-10(2)13-6-5-11(9-13)12(3)7-8-14-4;4*1-8(2)12-6-9(3)11(5)10(4)7-12;1-5-11(4)10-6-7-12(8-10)9(2)3;1-8(2)11-6-5-9(7-11)10(3)4;2*1-8(2)11-6-5-10(4)9(3)7-11;1-8(2)10-6-4-9(3)5-7-10/h10-11H,5-9H2,1-4H3;4*8-10H,6-7H2,1-5H3;9-10H,5-8H2,1-4H3;3*8-9H,5-7H2,1-4H3;8H,4-7H2,1-3H3/t11-;2*9-,10+;2*9-,10-;10-;3*9-;/m1..101110./s1.
What are the key properties of (2R)-1,2-dimethyl-4-propan-2-ylpiperazine;(2S)-1,2-dimethyl-4-propan-2-ylpiperazine;(3R)-N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;(3R)-N-ethyl-N-methyl-1-propan-2-ylpyrrolidin-3-amine;(3R)-N-(2-methoxyethyl)-N-methyl-1-propan-2-ylpyrrolidin-3-amine;1-methyl-4-propan-2-ylpiperazine;(2S,6S)-1,2,6-trimethyl-4-propan-2-ylpiperazine;(2R,6R)-1,2,6-trimethyl-4-propan-2-ylpiperazine;bis((2S,6R)-1,2,6-trimethyl-4-propan-2-ylpiperazine)?
(2R)-1,2-dimethyl-4-propan-2-ylpiperazine;(2S)-1,2-dimethyl-4-propan-2-ylpiperazine;(3R)-N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;(3R)-N-ethyl-N-methyl-1-propan-2-ylpyrrolidin-3-amine;(3R)-N-(2-methoxyethyl)-N-methyl-1-propan-2-ylpyrrolidin-3-amine;1-methyl-4-propan-2-ylpiperazine;(2S,6S)-1,2,6-trimethyl-4-propan-2-ylpiperazine;(2R,6R)-1,2,6-trimethyl-4-propan-2-ylpiperazine;bis((2S,6R)-1,2,6-trimethyl-4-propan-2-ylpiperazine) has a molecular weight of 1662.89 g/mol, XLogP of 11.88, 17 rotatable bonds, 0 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1,2-dimethyl-4-propan-2-ylpiperazine;(2S)-1,2-dimethyl-4-propan-2-ylpiperazine;(3R)-N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;(3R)-N-ethyl-N-methyl-1-propan-2-ylpyrrolidin-3-amine;(3R)-N-(2-methoxyethyl)-N-methyl-1-propan-2-ylpyrrolidin-3-amine;1-methyl-4-propan-2-ylpiperazine;(2S,6S)-1,2,6-trimethyl-4-propan-2-ylpiperazine;(2R,6R)-1,2,6-trimethyl-4-propan-2-ylpiperazine;bis((2S,6R)-1,2,6-trimethyl-4-propan-2-ylpiperazine) is sourced from PubChem (CID 159280460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).