1-propan-2-yl-4-[(4-propan-2-ylcyclohexyl)methyl]piperazine;1-propan-2-yl-4-[(4-propan-2-ylcyclohexyl)methyl]piperidine;tris(1-propan-2-yl-4-[(1-propan-2-ylpiperidin-4-yl)methyl]piperazine);1-propan-2-yl-4-[(1-propan-2-ylpiperidin-4-yl)methyl]piperidine;bis(1-propan-2-yl-4-[(4-propan-2-ylpiperidin-1-yl)methyl]piperidine)

C134H270N18 — CID 167629636

IUPAC1-propan-2-yl-4-[(4-propan-2-ylcyclohexyl)methyl]piperazine;1-propan-2-yl-4-[(4-propan-2-ylcyclohexyl)methyl]piperidine;tris(1-propan-2-yl-4-[(1-propan-2-ylpiperidin-4-yl)methyl]piperazine);1-propan-2-yl-4-[(1-propan-2-ylpiperidin-4-yl)methyl]piperidine;bis(1-propan-2-yl-4-[(4-propan-2-ylpiperidin-1-yl)methyl]piperidine)
SMILESCC(C)C1CCC(CC2CCN(C(C)C)CC2)CC1.CC(C)C1CCC(CN2CCN(C(C)C)CC2)CC1.CC(C)C1CCN(CC2CCN(C(C)C)CC2)CC1.CC(C)C1CCN(CC2CCN(C(C)C)CC2)CC1.CC(C)N1CCC(CC2CCN(C(C)C)CC2)CC1.CC(C)N1CCC(CN2CCN(C(C)C)CC2)CC1.CC(C)N1CCC(CN2CCN(C(C)C)CC2)CC1.CC(C)N1CCC(CN2CCN(C(C)C)CC2)CC1
InChIInChI=1S/C18H35N.4C17H34N2.3C16H33N3/c1-14(2)18-7-5-16(6-8-18)13-17-9-11-19(12-10-17)15(3)4;2*1-14(2)17-7-9-18(10-8-17)13-16-5-11-19(12-6-16)15(3)4;1-14(2)18-9-5-16(6-10-18)13-17-7-11-19(12-8-17)15(3)4;1-14(2)17-7-5-16(6-8-17)13-18-9-11-19(12-10-18)15(3)4;3*1-14(2)18-7-5-16(6-8-18)13-17-9-11-19(12-10-17)15(3)4/h14-18H,5-13H2,1-4H3;4*14-17H,5-13H2,1-4H3;3*14-16H,5-13H2,1-4H3
InChIKeyNPKBKFXEQJGLNL-UHFFFAOYSA-N
MW2133.76 g/mol
LogP25.40
Rot. Bonds32

About 1-propan-2-yl-4-[(4-propan-2-ylcyclohexyl)methyl]piperazine;1-propan-2-yl-4-[(4-propan-2-ylcyclohexyl)methyl]piperidine;tris(1-propan-2-yl-4-[(1-propan-2-ylpiperidin-4-yl)methyl]piperazine);1-propan-2-yl-4-[(1-propan-2-ylpiperidin-4-yl)methyl]piperidine;bis(1-propan-2-yl-4-[(4-propan-2-ylpiperidin-1-yl)methyl]piperidine)

1-propan-2-yl-4-[(4-propan-2-ylcyclohexyl)methyl]piperazine;1-propan-2-yl-4-[(4-propan-2-ylcyclohexyl)methyl]piperidine;tris(1-propan-2-yl-4-[(1-propan-2-ylpiperidin-4-yl)methyl]piperazine);1-propan-2-yl-4-[(1-propan-2-ylpiperidin-4-yl)methyl]piperidine;bis(1-propan-2-yl-4-[(4-propan-2-ylpiperidin-1-yl)methyl]piperidine) (PubChem CID 167629636) has the molecular formula C134H270N18 and a molecular weight of 2133.76 g/mol. Its IUPAC name is 1-propan-2-yl-4-[(4-propan-2-ylcyclohexyl)methyl]piperazine;1-propan-2-yl-4-[(4-propan-2-ylcyclohexyl)methyl]piperidine;tris(1-propan-2-yl-4-[(1-propan-2-ylpiperidin-4-yl)methyl]piperazine);1-propan-2-yl-4-[(1-propan-2-ylpiperidin-4-yl)methyl]piperidine;bis(1-propan-2-yl-4-[(4-propan-2-ylpiperidin-1-yl)methyl]piperidine).

Molecular Properties

Compound Name1-propan-2-yl-4-[(4-propan-2-ylcyclohexyl)methyl]piperazine;1-propan-2-yl-4-[(4-propan-2-ylcyclohexyl)methyl]piperidine;tris(1-propan-2-yl-4-[(1-propan-2-ylpiperidin-4-yl)methyl]piperazine);1-propan-2-yl-4-[(1-propan-2-ylpiperidin-4-yl)methyl]piperidine;bis(1-propan-2-yl-4-[(4-propan-2-ylpiperidin-1-yl)methyl]piperidine)
PubChem CID167629636
Molecular FormulaC134H270N18
Molecular Weight2133.76 g/mol
Exact Mass2132.17
IUPAC Name1-propan-2-yl-4-[(4-propan-2-ylcyclohexyl)methyl]piperazine;1-propan-2-yl-4-[(4-propan-2-ylcyclohexyl)methyl]piperidine;tris(1-propan-2-yl-4-[(1-propan-2-ylpiperidin-4-yl)methyl]piperazine);1-propan-2-yl-4-[(1-propan-2-ylpiperidin-4-yl)methyl]piperidine;bis(1-propan-2-yl-4-[(4-propan-2-ylpiperidin-1-yl)methyl]piperidine)
SMILESCC(C)C1CCC(CC2CCN(C(C)C)CC2)CC1.CC(C)C1CCC(CN2CCN(C(C)C)CC2)CC1.CC(C)C1CCN(CC2CCN(C(C)C)CC2)CC1.CC(C)C1CCN(CC2CCN(C(C)C)CC2)CC1.CC(C)N1CCC(CC2CCN(C(C)C)CC2)CC1.CC(C)N1CCC(CN2CCN(C(C)C)CC2)CC1.CC(C)N1CCC(CN2CCN(C(C)C)CC2)CC1.CC(C)N1CCC(CN2CCN(C(C)C)CC2)CC1
InChIInChI=1S/C18H35N.4C17H34N2.3C16H33N3/c1-14(2)18-7-5-16(6-8-18)13-17-9-11-19(12-10-17)15(3)4;2*1-14(2)17-7-9-18(10-8-17)13-16-5-11-19(12-6-16)15(3)4;1-14(2)18-9-5-16(6-10-18)13-17-7-11-19(12-8-17)15(3)4;1-14(2)17-7-5-16(6-8-17)13-18-9-11-19(12-10-18)15(3)4;3*1-14(2)18-7-5-16(6-8-18)13-17-9-11-19(12-10-17)15(3)4/h14-18H,5-13H2,1-4H3;4*14-17H,5-13H2,1-4H3;3*14-16H,5-13H2,1-4H3
InChIKeyNPKBKFXEQJGLNL-UHFFFAOYSA-N
XLogP25.40
TPSA58.32 Ų
H-Bond Donors
H-Bond Acceptors18
Rotatable Bonds32
Heavy Atoms152
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002133.76
LogP ≤ 525.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1018

Analyze 1-propan-2-yl-4-[(4-propan-2-ylcyclohexyl)methyl]piperazine;1-propan-2-yl-4-[(4-propan-2-ylcyclohexyl)methyl]piperidine;tris(1-propan-2-yl-4-[(1-propan-2-ylpiperidin-4-yl)methyl]piperazine);1-propan-2-yl-4-[(1-propan-2-ylpiperidin-4-yl)methyl]piperidine;bis(1-propan-2-yl-4-[(4-propan-2-ylpiperidin-1-yl)methyl]piperidine) with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-propan-2-yl-4-[(4-propan-2-ylcyclohexyl)methyl]piperazine;1-propan-2-yl-4-[(4-propan-2-ylcyclohexyl)methyl]piperidine;tris(1-propan-2-yl-4-[(1-propan-2-ylpiperidin-4-yl)methyl]piperazine);1-propan-2-yl-4-[(1-propan-2-ylpiperidin-4-yl)methyl]piperidine;bis(1-propan-2-yl-4-[(4-propan-2-ylpiperidin-1-yl)methyl]piperidine)?
The IUPAC name of 1-propan-2-yl-4-[(4-propan-2-ylcyclohexyl)methyl]piperazine;1-propan-2-yl-4-[(4-propan-2-ylcyclohexyl)methyl]piperidine;tris(1-propan-2-yl-4-[(1-propan-2-ylpiperidin-4-yl)methyl]piperazine);1-propan-2-yl-4-[(1-propan-2-ylpiperidin-4-yl)methyl]piperidine;bis(1-propan-2-yl-4-[(4-propan-2-ylpiperidin-1-yl)methyl]piperidine) (CID 167629636) is 1-propan-2-yl-4-[(4-propan-2-ylcyclohexyl)methyl]piperazine;1-propan-2-yl-4-[(4-propan-2-ylcyclohexyl)methyl]piperidine;tris(1-propan-2-yl-4-[(1-propan-2-ylpiperidin-4-yl)methyl]piperazine);1-propan-2-yl-4-[(1-propan-2-ylpiperidin-4-yl)methyl]piperidine;bis(1-propan-2-yl-4-[(4-propan-2-ylpiperidin-1-yl)methyl]piperidine).
What is the SMILES notation for 1-propan-2-yl-4-[(4-propan-2-ylcyclohexyl)methyl]piperazine;1-propan-2-yl-4-[(4-propan-2-ylcyclohexyl)methyl]piperidine;tris(1-propan-2-yl-4-[(1-propan-2-ylpiperidin-4-yl)methyl]piperazine);1-propan-2-yl-4-[(1-propan-2-ylpiperidin-4-yl)methyl]piperidine;bis(1-propan-2-yl-4-[(4-propan-2-ylpiperidin-1-yl)methyl]piperidine)?
The canonical SMILES for 1-propan-2-yl-4-[(4-propan-2-ylcyclohexyl)methyl]piperazine;1-propan-2-yl-4-[(4-propan-2-ylcyclohexyl)methyl]piperidine;tris(1-propan-2-yl-4-[(1-propan-2-ylpiperidin-4-yl)methyl]piperazine);1-propan-2-yl-4-[(1-propan-2-ylpiperidin-4-yl)methyl]piperidine;bis(1-propan-2-yl-4-[(4-propan-2-ylpiperidin-1-yl)methyl]piperidine) is CC(C)C1CCC(CC2CCN(C(C)C)CC2)CC1.CC(C)C1CCC(CN2CCN(C(C)C)CC2)CC1.CC(C)C1CCN(CC2CCN(C(C)C)CC2)CC1.CC(C)C1CCN(CC2CCN(C(C)C)CC2)CC1.CC(C)N1CCC(CC2CCN(C(C)C)CC2)CC1.CC(C)N1CCC(CN2CCN(C(C)C)CC2)CC1.CC(C)N1CCC(CN2CCN(C(C)C)CC2)CC1.CC(C)N1CCC(CN2CCN(C(C)C)CC2)CC1.
What is the InChIKey of 1-propan-2-yl-4-[(4-propan-2-ylcyclohexyl)methyl]piperazine;1-propan-2-yl-4-[(4-propan-2-ylcyclohexyl)methyl]piperidine;tris(1-propan-2-yl-4-[(1-propan-2-ylpiperidin-4-yl)methyl]piperazine);1-propan-2-yl-4-[(1-propan-2-ylpiperidin-4-yl)methyl]piperidine;bis(1-propan-2-yl-4-[(4-propan-2-ylpiperidin-1-yl)methyl]piperidine)?
The InChIKey is NPKBKFXEQJGLNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H35N.4C17H34N2.3C16H33N3/c1-14(2)18-7-5-16(6-8-18)13-17-9-11-19(12-10-17)15(3)4;2*1-14(2)17-7-9-18(10-8-17)13-16-5-11-19(12-6-16)15(3)4;1-14(2)18-9-5-16(6-10-18)13-17-7-11-19(12-8-17)15(3)4;1-14(2)17-7-5-16(6-8-17)13-18-9-11-19(12-10-18)15(3)4;3*1-14(2)18-7-5-16(6-8-18)13-17-9-11-19(12-10-17)15(3)4/h14-18H,5-13H2,1-4H3;4*14-17H,5-13H2,1-4H3;3*14-16H,5-13H2,1-4H3.
What are the key properties of 1-propan-2-yl-4-[(4-propan-2-ylcyclohexyl)methyl]piperazine;1-propan-2-yl-4-[(4-propan-2-ylcyclohexyl)methyl]piperidine;tris(1-propan-2-yl-4-[(1-propan-2-ylpiperidin-4-yl)methyl]piperazine);1-propan-2-yl-4-[(1-propan-2-ylpiperidin-4-yl)methyl]piperidine;bis(1-propan-2-yl-4-[(4-propan-2-ylpiperidin-1-yl)methyl]piperidine)?
1-propan-2-yl-4-[(4-propan-2-ylcyclohexyl)methyl]piperazine;1-propan-2-yl-4-[(4-propan-2-ylcyclohexyl)methyl]piperidine;tris(1-propan-2-yl-4-[(1-propan-2-ylpiperidin-4-yl)methyl]piperazine);1-propan-2-yl-4-[(1-propan-2-ylpiperidin-4-yl)methyl]piperidine;bis(1-propan-2-yl-4-[(4-propan-2-ylpiperidin-1-yl)methyl]piperidine) has a molecular weight of 2133.76 g/mol, XLogP of 25.40, 32 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 1-propan-2-yl-4-[(4-propan-2-ylcyclohexyl)methyl]piperazine;1-propan-2-yl-4-[(4-propan-2-ylcyclohexyl)methyl]piperidine;tris(1-propan-2-yl-4-[(1-propan-2-ylpiperidin-4-yl)methyl]piperazine);1-propan-2-yl-4-[(1-propan-2-ylpiperidin-4-yl)methyl]piperidine;bis(1-propan-2-yl-4-[(4-propan-2-ylpiperidin-1-yl)methyl]piperidine) is sourced from PubChem (CID 167629636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).