1-[2-[1-[2-[2-[1-(2-aminopropoxy)propan-2-yloxy]propoxy]propoxy]propan-2-yloxy]propoxy]propan-2-amine

C21H46N2O6 — CID 129028378

IUPAC1-[2-[1-[2-[2-[1-(2-aminopropoxy)propan-2-yloxy]propoxy]propoxy]propan-2-yloxy]propoxy]propan-2-amine
SMILESCC(N)COCC(C)OC(C)COCC(C)OCC(C)OC(C)COCC(C)N
InChIInChI=1S/C21H46N2O6/c1-15(22)8-24-11-18(4)28-20(6)13-26-10-17(3)27-14-21(7)29-19(5)12-25-9-16(2)23/h15-21H,8-14,22-23H2,1-7H3
InChIKeyKFGXKSYASJFITB-UHFFFAOYSA-N
MW422.61 g/mol
LogP1.72
Rot. Bonds19

About 1-[2-[1-[2-[2-[1-(2-aminopropoxy)propan-2-yloxy]propoxy]propoxy]propan-2-yloxy]propoxy]propan-2-amine

1-[2-[1-[2-[2-[1-(2-aminopropoxy)propan-2-yloxy]propoxy]propoxy]propan-2-yloxy]propoxy]propan-2-amine (PubChem CID 129028378) has the molecular formula C21H46N2O6 and a molecular weight of 422.61 g/mol. Its IUPAC name is 1-[2-[1-[2-[2-[1-(2-aminopropoxy)propan-2-yloxy]propoxy]propoxy]propan-2-yloxy]propoxy]propan-2-amine.

Molecular Properties

Compound Name1-[2-[1-[2-[2-[1-(2-aminopropoxy)propan-2-yloxy]propoxy]propoxy]propan-2-yloxy]propoxy]propan-2-amine
PubChem CID129028378
Molecular FormulaC21H46N2O6
Molecular Weight422.61 g/mol
Exact Mass422.34
IUPAC Name1-[2-[1-[2-[2-[1-(2-aminopropoxy)propan-2-yloxy]propoxy]propoxy]propan-2-yloxy]propoxy]propan-2-amine
SMILESCC(N)COCC(C)OC(C)COCC(C)OCC(C)OC(C)COCC(C)N
InChIInChI=1S/C21H46N2O6/c1-15(22)8-24-11-18(4)28-20(6)13-26-10-17(3)27-14-21(7)29-19(5)12-25-9-16(2)23/h15-21H,8-14,22-23H2,1-7H3
InChIKeyKFGXKSYASJFITB-UHFFFAOYSA-N
XLogP1.72
TPSA107.42 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds19
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500422.61
LogP ≤ 51.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze 1-[2-[1-[2-[2-[1-(2-aminopropoxy)propan-2-yloxy]propoxy]propoxy]propan-2-yloxy]propoxy]propan-2-amine with MolForge

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Related Compounds

1-[2-[1-(2-aminopropoxy)propan-2-yloxy]ethoxy]propan-2-amine;methane;yttrium
CID 159748487
(2R)-1-[(2R)-1-[(2R)-1-(2-methoxyethoxy)propan-2-yl]oxypropan-2-yl]oxypropan-2-amine
CID 157049295
2-[2-(2-aminopropoxy)propoxy]propan-1-amine
CID 14122882
1-[4-[2-(2-aminopropoxy)propoxy]butoxy]propan-2-amine;azane;methane;yttrium
CID 159274573
2-[2-(2-aminopropoxy)propoxy]propan-1-amine;methane
CID 159510670
2-[1-[1-(1-phosphanyloxypropan-2-yloxy)propan-2-yloxy]propan-2-yloxy]propoxyphosphane
CID 59288681
1-[1-[2-(2-amino-2-chloroethoxy)ethoxy]propan-2-yloxy]propan-2-amine
CID 59972165
2-[2-[2-(2-aminopropoxy)propoxy]ethoxy]propan-1-amine
CID 58898571
2-(2-chloroethoxy)-1-[2-[2-(2-chloroethoxy)propoxy]propoxy]propane
CID 71321218
2-ethoxy-1-(2-ethoxypropoxy)propane
CID 21277912
1-[2-[2,3-di(propan-2-yloxy)propoxy]propoxy]-2,3-di(propan-2-yloxy)propane
CID 135274448
2-methyl-1-(2-methylpropoxy)propane;2-methyl-1-[2-(2-methylpropoxy)propoxy]propane;propane
CID 162007152

Frequently Asked Questions

What is the IUPAC name of 1-[2-[1-[2-[2-[1-(2-aminopropoxy)propan-2-yloxy]propoxy]propoxy]propan-2-yloxy]propoxy]propan-2-amine?
The IUPAC name of 1-[2-[1-[2-[2-[1-(2-aminopropoxy)propan-2-yloxy]propoxy]propoxy]propan-2-yloxy]propoxy]propan-2-amine (CID 129028378) is 1-[2-[1-[2-[2-[1-(2-aminopropoxy)propan-2-yloxy]propoxy]propoxy]propan-2-yloxy]propoxy]propan-2-amine.
What is the SMILES notation for 1-[2-[1-[2-[2-[1-(2-aminopropoxy)propan-2-yloxy]propoxy]propoxy]propan-2-yloxy]propoxy]propan-2-amine?
The canonical SMILES for 1-[2-[1-[2-[2-[1-(2-aminopropoxy)propan-2-yloxy]propoxy]propoxy]propan-2-yloxy]propoxy]propan-2-amine is CC(N)COCC(C)OC(C)COCC(C)OCC(C)OC(C)COCC(C)N.
What is the InChIKey of 1-[2-[1-[2-[2-[1-(2-aminopropoxy)propan-2-yloxy]propoxy]propoxy]propan-2-yloxy]propoxy]propan-2-amine?
The InChIKey is KFGXKSYASJFITB-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H46N2O6/c1-15(22)8-24-11-18(4)28-20(6)13-26-10-17(3)27-14-21(7)29-19(5)12-25-9-16(2)23/h15-21H,8-14,22-23H2,1-7H3.
What are the key properties of 1-[2-[1-[2-[2-[1-(2-aminopropoxy)propan-2-yloxy]propoxy]propoxy]propan-2-yloxy]propoxy]propan-2-amine?
1-[2-[1-[2-[2-[1-(2-aminopropoxy)propan-2-yloxy]propoxy]propoxy]propan-2-yloxy]propoxy]propan-2-amine has a molecular weight of 422.61 g/mol, XLogP of 1.72, 19 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[1-[2-[2-[1-(2-aminopropoxy)propan-2-yloxy]propoxy]propoxy]propan-2-yloxy]propoxy]propan-2-amine is sourced from PubChem (CID 129028378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).