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

C113H183N21O6 — CID 160983967

IUPAC1-methyl-4-[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]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;1-[3-[(3S)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]piperazine;1-[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]piperazine;1-[3-(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(C2CCOC2)c(N2CCNCC2)n1.CC(C)c1ccc(CN2CCN(C)CC2(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([C@@H]2CCOC2)c(N2CCNCC2)n1.CC(C)c1ccc([C@H]2CCOC2)c(N2CCN(C)CC2)n1.CC(C)c1ccc([C@H]2CCOC2)c(N2CCNCC2)n1
InChIInChI=1S/C17H27N3O.3C16H25N3O.2C16H27N3O.C16H27N3/c1-13(2)16-5-4-15(14-6-11-21-12-14)17(18-16)20-9-7-19(3)8-10-20;3*1-12(2)15-4-3-14(13-5-10-20-11-13)16(18-15)19-8-6-17-7-9-19;2*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/h4-5,13-14H,6-12H2,1-3H3;3*3-4,12-13,17H,5-11H2,1-2H3;2*6-7,10,12,15,20H,8-9,11H2,1-5H3;6-7,10,13H,8-9,11-12H2,1-5H3/t14-;2*13-;;15-;;/m010.1../s1
InChIKeySZWLKUKPWYLHPT-JZZBTYPNSA-N
MW1931.85 g/mol
LogP15.74
Rot. Bonds21

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

1-methyl-4-[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]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;1-[3-[(3S)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]piperazine;1-[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]piperazine;1-[3-(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 160983967) has the molecular formula C113H183N21O6 and a molecular weight of 1931.85 g/mol. Its IUPAC name is 1-methyl-4-[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]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;1-[3-[(3S)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]piperazine;1-[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]piperazine;1-[3-(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 Name1-methyl-4-[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]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;1-[3-[(3S)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]piperazine;1-[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]piperazine;1-[3-(oxolan-3-yl)-6-propan-2-yl-2-pyridinyl]piperazine;2,2,4-trimethyl-1-[(6-propan-2-yl-3-pyridinyl)methyl]piperazine
PubChem CID160983967
Molecular FormulaC113H183N21O6
Molecular Weight1931.85 g/mol
Exact Mass1930.47
IUPAC Name1-methyl-4-[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]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;1-[3-[(3S)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]piperazine;1-[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]piperazine;1-[3-(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(C2CCOC2)c(N2CCNCC2)n1.CC(C)c1ccc(CN2CCN(C)CC2(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([C@@H]2CCOC2)c(N2CCNCC2)n1.CC(C)c1ccc([C@H]2CCOC2)c(N2CCN(C)CC2)n1.CC(C)c1ccc([C@H]2CCOC2)c(N2CCNCC2)n1
InChIInChI=1S/C17H27N3O.3C16H25N3O.2C16H27N3O.C16H27N3/c1-13(2)16-5-4-15(14-6-11-21-12-14)17(18-16)20-9-7-19(3)8-10-20;3*1-12(2)15-4-3-14(13-5-10-20-11-13)16(18-15)19-8-6-17-7-9-19;2*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/h4-5,13-14H,6-12H2,1-3H3;3*3-4,12-13,17H,5-11H2,1-2H3;2*6-7,10,12,15,20H,8-9,11H2,1-5H3;6-7,10,13H,8-9,11-12H2,1-5H3/t14-;2*13-;;15-;;/m010.1../s1
InChIKeySZWLKUKPWYLHPT-JZZBTYPNSA-N
XLogP15.74
TPSA239.34 Ų
H-Bond Donors5
H-Bond Acceptors27
Rotatable Bonds21
Heavy Atoms140
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001931.85
LogP ≤ 515.74
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1027

Analyze 1-methyl-4-[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]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;1-[3-[(3S)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]piperazine;1-[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]piperazine;1-[3-(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 1-methyl-4-[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]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;1-[3-[(3S)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]piperazine;1-[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]piperazine;1-[3-(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 1-methyl-4-[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]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;1-[3-[(3S)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]piperazine;1-[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]piperazine;1-[3-(oxolan-3-yl)-6-propan-2-yl-2-pyridinyl]piperazine;2,2,4-trimethyl-1-[(6-propan-2-yl-3-pyridinyl)methyl]piperazine (CID 160983967) is 1-methyl-4-[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]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;1-[3-[(3S)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]piperazine;1-[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]piperazine;1-[3-(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 1-methyl-4-[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]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;1-[3-[(3S)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]piperazine;1-[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]piperazine;1-[3-(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 1-methyl-4-[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]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;1-[3-[(3S)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]piperazine;1-[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]piperazine;1-[3-(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(C2CCOC2)c(N2CCNCC2)n1.CC(C)c1ccc(CN2CCN(C)CC2(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([C@@H]2CCOC2)c(N2CCNCC2)n1.CC(C)c1ccc([C@H]2CCOC2)c(N2CCN(C)CC2)n1.CC(C)c1ccc([C@H]2CCOC2)c(N2CCNCC2)n1.
What is the InChIKey of 1-methyl-4-[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]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;1-[3-[(3S)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]piperazine;1-[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]piperazine;1-[3-(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 SZWLKUKPWYLHPT-JZZBTYPNSA-N. The full InChI is InChI=1S/C17H27N3O.3C16H25N3O.2C16H27N3O.C16H27N3/c1-13(2)16-5-4-15(14-6-11-21-12-14)17(18-16)20-9-7-19(3)8-10-20;3*1-12(2)15-4-3-14(13-5-10-20-11-13)16(18-15)19-8-6-17-7-9-19;2*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/h4-5,13-14H,6-12H2,1-3H3;3*3-4,12-13,17H,5-11H2,1-2H3;2*6-7,10,12,15,20H,8-9,11H2,1-5H3;6-7,10,13H,8-9,11-12H2,1-5H3/t14-;2*13-;;15-;;/m010.1../s1.
What are the key properties of 1-methyl-4-[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]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;1-[3-[(3S)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]piperazine;1-[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]piperazine;1-[3-(oxolan-3-yl)-6-propan-2-yl-2-pyridinyl]piperazine;2,2,4-trimethyl-1-[(6-propan-2-yl-3-pyridinyl)methyl]piperazine?
1-methyl-4-[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]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;1-[3-[(3S)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]piperazine;1-[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]piperazine;1-[3-(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 1931.85 g/mol, XLogP of 15.74, 21 rotatable bonds, 5 hydrogen bond donors, and 27 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]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;1-[3-[(3S)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]piperazine;1-[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]piperazine;1-[3-(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 160983967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).