2,2-dimethyl-1-[(6-propan-2-yl-3-pyridinyl)methyl]piperazine;1-methyl-4-(2-methyl-6-propan-2-yl-3-pyridinyl)piperazine;1-methyl-4-[(6-propan-2-yl-3-pyridinyl)methyl]piperazine;2-[1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperazin-2-yl]propan-2-ol;2-[(2R)-1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperazin-2-yl]propan-2-ol;2-[(2S)-1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperazin-2-yl]propan-2-ol;1-[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]piperazine;2,2,4-trimethyl-1-[(6-propan-2-yl-3-pyridinyl)methyl]piperazine

C123H204N24O4 — CID 159101535

IUPAC2,2-dimethyl-1-[(6-propan-2-yl-3-pyridinyl)methyl]piperazine;1-methyl-4-(2-methyl-6-propan-2-yl-3-pyridinyl)piperazine;1-methyl-4-[(6-propan-2-yl-3-pyridinyl)methyl]piperazine;2-[1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperazin-2-yl]propan-2-ol;2-[(2R)-1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperazin-2-yl]propan-2-ol;2-[(2S)-1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperazin-2-yl]propan-2-ol;1-[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]piperazine;2,2,4-trimethyl-1-[(6-propan-2-yl-3-pyridinyl)methyl]piperazine
SMILESCC(C)c1ccc(CN2CCN(C)CC2(C)C)cn1.CC(C)c1ccc(CN2CCN(C)CC2)cn1.CC(C)c1ccc(CN2CCNCC2(C)C)cn1.CC(C)c1ccc(N2CCN(C)C(C(C)(C)O)C2)cn1.CC(C)c1ccc(N2CCN(C)[C@@H](C(C)(C)O)C2)cn1.CC(C)c1ccc(N2CCN(C)[C@H](C(C)(C)O)C2)cn1.CC(C)c1ccc([C@H]2CCOC2)c(N2CCNCC2)n1.Cc1nc(C(C)C)ccc1N1CCN(C)CC1
InChIInChI=1S/C16H25N3O.3C16H27N3O.C16H27N3.C15H25N3.2C14H23N3/c1-12(2)15-4-3-14(13-5-10-20-11-13)16(18-15)19-8-6-17-7-9-19;3*1-12(2)14-7-6-13(10-17-14)19-9-8-18(5)15(11-19)16(3,4)20;1-13(2)15-7-6-14(10-17-15)11-19-9-8-18(5)12-16(19,3)4;1-12(2)14-6-5-13(9-17-14)10-18-8-7-16-11-15(18,3)4;1-11(2)13-5-6-14(12(3)15-13)17-9-7-16(4)8-10-17;1-12(2)14-5-4-13(10-15-14)11-17-8-6-16(3)7-9-17/h3-4,12-13,17H,5-11H2,1-2H3;3*6-7,10,12,15,20H,8-9,11H2,1-5H3;6-7,10,13H,8-9,11-12H2,1-5H3;5-6,9,12,16H,7-8,10-11H2,1-4H3;5-6,11H,7-10H2,1-4H3;4-5,10,12H,6-9,11H2,1-3H3/t13-;2*15-;;;;;/m010...../s1
InChIKeyKDIPZOGESIGPCZ-NDWOQASDSA-N
MW2083.15 g/mol
LogP17.74
Rot. Bonds23

About 2,2-dimethyl-1-[(6-propan-2-yl-3-pyridinyl)methyl]piperazine;1-methyl-4-(2-methyl-6-propan-2-yl-3-pyridinyl)piperazine;1-methyl-4-[(6-propan-2-yl-3-pyridinyl)methyl]piperazine;2-[1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperazin-2-yl]propan-2-ol;2-[(2R)-1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperazin-2-yl]propan-2-ol;2-[(2S)-1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperazin-2-yl]propan-2-ol;1-[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]piperazine;2,2,4-trimethyl-1-[(6-propan-2-yl-3-pyridinyl)methyl]piperazine

2,2-dimethyl-1-[(6-propan-2-yl-3-pyridinyl)methyl]piperazine;1-methyl-4-(2-methyl-6-propan-2-yl-3-pyridinyl)piperazine;1-methyl-4-[(6-propan-2-yl-3-pyridinyl)methyl]piperazine;2-[1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperazin-2-yl]propan-2-ol;2-[(2R)-1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperazin-2-yl]propan-2-ol;2-[(2S)-1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperazin-2-yl]propan-2-ol;1-[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]piperazine;2,2,4-trimethyl-1-[(6-propan-2-yl-3-pyridinyl)methyl]piperazine (PubChem CID 159101535) has the molecular formula C123H204N24O4 and a molecular weight of 2083.15 g/mol. Its IUPAC name is 2,2-dimethyl-1-[(6-propan-2-yl-3-pyridinyl)methyl]piperazine;1-methyl-4-(2-methyl-6-propan-2-yl-3-pyridinyl)piperazine;1-methyl-4-[(6-propan-2-yl-3-pyridinyl)methyl]piperazine;2-[1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperazin-2-yl]propan-2-ol;2-[(2R)-1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperazin-2-yl]propan-2-ol;2-[(2S)-1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperazin-2-yl]propan-2-ol;1-[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]piperazine;2,2,4-trimethyl-1-[(6-propan-2-yl-3-pyridinyl)methyl]piperazine.

Molecular Properties

Compound Name2,2-dimethyl-1-[(6-propan-2-yl-3-pyridinyl)methyl]piperazine;1-methyl-4-(2-methyl-6-propan-2-yl-3-pyridinyl)piperazine;1-methyl-4-[(6-propan-2-yl-3-pyridinyl)methyl]piperazine;2-[1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperazin-2-yl]propan-2-ol;2-[(2R)-1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperazin-2-yl]propan-2-ol;2-[(2S)-1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperazin-2-yl]propan-2-ol;1-[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]piperazine;2,2,4-trimethyl-1-[(6-propan-2-yl-3-pyridinyl)methyl]piperazine
PubChem CID159101535
Molecular FormulaC123H204N24O4
Molecular Weight2083.15 g/mol
Exact Mass2081.65
IUPAC Name2,2-dimethyl-1-[(6-propan-2-yl-3-pyridinyl)methyl]piperazine;1-methyl-4-(2-methyl-6-propan-2-yl-3-pyridinyl)piperazine;1-methyl-4-[(6-propan-2-yl-3-pyridinyl)methyl]piperazine;2-[1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperazin-2-yl]propan-2-ol;2-[(2R)-1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperazin-2-yl]propan-2-ol;2-[(2S)-1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperazin-2-yl]propan-2-ol;1-[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]piperazine;2,2,4-trimethyl-1-[(6-propan-2-yl-3-pyridinyl)methyl]piperazine
SMILESCC(C)c1ccc(CN2CCN(C)CC2(C)C)cn1.CC(C)c1ccc(CN2CCN(C)CC2)cn1.CC(C)c1ccc(CN2CCNCC2(C)C)cn1.CC(C)c1ccc(N2CCN(C)C(C(C)(C)O)C2)cn1.CC(C)c1ccc(N2CCN(C)[C@@H](C(C)(C)O)C2)cn1.CC(C)c1ccc(N2CCN(C)[C@H](C(C)(C)O)C2)cn1.CC(C)c1ccc([C@H]2CCOC2)c(N2CCNCC2)n1.Cc1nc(C(C)C)ccc1N1CCN(C)CC1
InChIInChI=1S/C16H25N3O.3C16H27N3O.C16H27N3.C15H25N3.2C14H23N3/c1-12(2)15-4-3-14(13-5-10-20-11-13)16(18-15)19-8-6-17-7-9-19;3*1-12(2)14-7-6-13(10-17-14)19-9-8-18(5)15(11-19)16(3,4)20;1-13(2)15-7-6-14(10-17-15)11-19-9-8-18(5)12-16(19,3)4;1-12(2)14-6-5-13(9-17-14)10-18-8-7-16-11-15(18,3)4;1-11(2)13-5-6-14(12(3)15-13)17-9-7-16(4)8-10-17;1-12(2)14-5-4-13(10-15-14)11-17-8-6-16(3)7-9-17/h3-4,12-13,17H,5-11H2,1-2H3;3*6-7,10,12,15,20H,8-9,11H2,1-5H3;6-7,10,13H,8-9,11-12H2,1-5H3;5-6,9,12,16H,7-8,10-11H2,1-4H3;5-6,11H,7-10H2,1-4H3;4-5,10,12H,6-9,11H2,1-3H3/t13-;2*15-;;;;;/m010...../s1
InChIKeyKDIPZOGESIGPCZ-NDWOQASDSA-N
XLogP17.74
TPSA242.46 Ų
H-Bond Donors5
H-Bond Acceptors28
Rotatable Bonds23
Heavy Atoms151
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002083.15
LogP ≤ 517.74
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1028

Analyze 2,2-dimethyl-1-[(6-propan-2-yl-3-pyridinyl)methyl]piperazine;1-methyl-4-(2-methyl-6-propan-2-yl-3-pyridinyl)piperazine;1-methyl-4-[(6-propan-2-yl-3-pyridinyl)methyl]piperazine;2-[1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperazin-2-yl]propan-2-ol;2-[(2R)-1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperazin-2-yl]propan-2-ol;2-[(2S)-1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperazin-2-yl]propan-2-ol;1-[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]piperazine;2,2,4-trimethyl-1-[(6-propan-2-yl-3-pyridinyl)methyl]piperazine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-1-[(6-propan-2-yl-3-pyridinyl)methyl]piperazine;1-methyl-4-(2-methyl-6-propan-2-yl-3-pyridinyl)piperazine;1-methyl-4-[(6-propan-2-yl-3-pyridinyl)methyl]piperazine;2-[1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperazin-2-yl]propan-2-ol;2-[(2R)-1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperazin-2-yl]propan-2-ol;2-[(2S)-1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperazin-2-yl]propan-2-ol;1-[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]piperazine;2,2,4-trimethyl-1-[(6-propan-2-yl-3-pyridinyl)methyl]piperazine?
The IUPAC name of 2,2-dimethyl-1-[(6-propan-2-yl-3-pyridinyl)methyl]piperazine;1-methyl-4-(2-methyl-6-propan-2-yl-3-pyridinyl)piperazine;1-methyl-4-[(6-propan-2-yl-3-pyridinyl)methyl]piperazine;2-[1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperazin-2-yl]propan-2-ol;2-[(2R)-1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperazin-2-yl]propan-2-ol;2-[(2S)-1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperazin-2-yl]propan-2-ol;1-[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]piperazine;2,2,4-trimethyl-1-[(6-propan-2-yl-3-pyridinyl)methyl]piperazine (CID 159101535) is 2,2-dimethyl-1-[(6-propan-2-yl-3-pyridinyl)methyl]piperazine;1-methyl-4-(2-methyl-6-propan-2-yl-3-pyridinyl)piperazine;1-methyl-4-[(6-propan-2-yl-3-pyridinyl)methyl]piperazine;2-[1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperazin-2-yl]propan-2-ol;2-[(2R)-1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperazin-2-yl]propan-2-ol;2-[(2S)-1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperazin-2-yl]propan-2-ol;1-[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]piperazine;2,2,4-trimethyl-1-[(6-propan-2-yl-3-pyridinyl)methyl]piperazine.
What is the SMILES notation for 2,2-dimethyl-1-[(6-propan-2-yl-3-pyridinyl)methyl]piperazine;1-methyl-4-(2-methyl-6-propan-2-yl-3-pyridinyl)piperazine;1-methyl-4-[(6-propan-2-yl-3-pyridinyl)methyl]piperazine;2-[1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperazin-2-yl]propan-2-ol;2-[(2R)-1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperazin-2-yl]propan-2-ol;2-[(2S)-1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperazin-2-yl]propan-2-ol;1-[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]piperazine;2,2,4-trimethyl-1-[(6-propan-2-yl-3-pyridinyl)methyl]piperazine?
The canonical SMILES for 2,2-dimethyl-1-[(6-propan-2-yl-3-pyridinyl)methyl]piperazine;1-methyl-4-(2-methyl-6-propan-2-yl-3-pyridinyl)piperazine;1-methyl-4-[(6-propan-2-yl-3-pyridinyl)methyl]piperazine;2-[1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperazin-2-yl]propan-2-ol;2-[(2R)-1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperazin-2-yl]propan-2-ol;2-[(2S)-1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperazin-2-yl]propan-2-ol;1-[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]piperazine;2,2,4-trimethyl-1-[(6-propan-2-yl-3-pyridinyl)methyl]piperazine is CC(C)c1ccc(CN2CCN(C)CC2(C)C)cn1.CC(C)c1ccc(CN2CCN(C)CC2)cn1.CC(C)c1ccc(CN2CCNCC2(C)C)cn1.CC(C)c1ccc(N2CCN(C)C(C(C)(C)O)C2)cn1.CC(C)c1ccc(N2CCN(C)[C@@H](C(C)(C)O)C2)cn1.CC(C)c1ccc(N2CCN(C)[C@H](C(C)(C)O)C2)cn1.CC(C)c1ccc([C@H]2CCOC2)c(N2CCNCC2)n1.Cc1nc(C(C)C)ccc1N1CCN(C)CC1.
What is the InChIKey of 2,2-dimethyl-1-[(6-propan-2-yl-3-pyridinyl)methyl]piperazine;1-methyl-4-(2-methyl-6-propan-2-yl-3-pyridinyl)piperazine;1-methyl-4-[(6-propan-2-yl-3-pyridinyl)methyl]piperazine;2-[1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperazin-2-yl]propan-2-ol;2-[(2R)-1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperazin-2-yl]propan-2-ol;2-[(2S)-1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperazin-2-yl]propan-2-ol;1-[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]piperazine;2,2,4-trimethyl-1-[(6-propan-2-yl-3-pyridinyl)methyl]piperazine?
The InChIKey is KDIPZOGESIGPCZ-NDWOQASDSA-N. The full InChI is InChI=1S/C16H25N3O.3C16H27N3O.C16H27N3.C15H25N3.2C14H23N3/c1-12(2)15-4-3-14(13-5-10-20-11-13)16(18-15)19-8-6-17-7-9-19;3*1-12(2)14-7-6-13(10-17-14)19-9-8-18(5)15(11-19)16(3,4)20;1-13(2)15-7-6-14(10-17-15)11-19-9-8-18(5)12-16(19,3)4;1-12(2)14-6-5-13(9-17-14)10-18-8-7-16-11-15(18,3)4;1-11(2)13-5-6-14(12(3)15-13)17-9-7-16(4)8-10-17;1-12(2)14-5-4-13(10-15-14)11-17-8-6-16(3)7-9-17/h3-4,12-13,17H,5-11H2,1-2H3;3*6-7,10,12,15,20H,8-9,11H2,1-5H3;6-7,10,13H,8-9,11-12H2,1-5H3;5-6,9,12,16H,7-8,10-11H2,1-4H3;5-6,11H,7-10H2,1-4H3;4-5,10,12H,6-9,11H2,1-3H3/t13-;2*15-;;;;;/m010...../s1.
What are the key properties of 2,2-dimethyl-1-[(6-propan-2-yl-3-pyridinyl)methyl]piperazine;1-methyl-4-(2-methyl-6-propan-2-yl-3-pyridinyl)piperazine;1-methyl-4-[(6-propan-2-yl-3-pyridinyl)methyl]piperazine;2-[1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperazin-2-yl]propan-2-ol;2-[(2R)-1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperazin-2-yl]propan-2-ol;2-[(2S)-1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperazin-2-yl]propan-2-ol;1-[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]piperazine;2,2,4-trimethyl-1-[(6-propan-2-yl-3-pyridinyl)methyl]piperazine?
2,2-dimethyl-1-[(6-propan-2-yl-3-pyridinyl)methyl]piperazine;1-methyl-4-(2-methyl-6-propan-2-yl-3-pyridinyl)piperazine;1-methyl-4-[(6-propan-2-yl-3-pyridinyl)methyl]piperazine;2-[1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperazin-2-yl]propan-2-ol;2-[(2R)-1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperazin-2-yl]propan-2-ol;2-[(2S)-1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperazin-2-yl]propan-2-ol;1-[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]piperazine;2,2,4-trimethyl-1-[(6-propan-2-yl-3-pyridinyl)methyl]piperazine has a molecular weight of 2083.15 g/mol, XLogP of 17.74, 23 rotatable bonds, 5 hydrogen bond donors, and 28 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-1-[(6-propan-2-yl-3-pyridinyl)methyl]piperazine;1-methyl-4-(2-methyl-6-propan-2-yl-3-pyridinyl)piperazine;1-methyl-4-[(6-propan-2-yl-3-pyridinyl)methyl]piperazine;2-[1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperazin-2-yl]propan-2-ol;2-[(2R)-1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperazin-2-yl]propan-2-ol;2-[(2S)-1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperazin-2-yl]propan-2-ol;1-[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]piperazine;2,2,4-trimethyl-1-[(6-propan-2-yl-3-pyridinyl)methyl]piperazine is sourced from PubChem (CID 159101535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).