1-[2-[1-(2-aminopropoxy)propan-2-yloxy]ethoxy]propan-2-amine;methane;yttrium

C13H34N2O3Y — CID 159748487

IUPAC1-[2-[1-(2-aminopropoxy)propan-2-yloxy]ethoxy]propan-2-amine;methane;yttrium
SMILESC.C.CC(N)COCCOC(C)COCC(C)N.[Y]
InChIInChI=1S/C11H26N2O3.2CH4.Y/c1-9(12)6-14-4-5-16-11(3)8-15-7-10(2)13;;;/h9-11H,4-8,12-13H2,1-3H3;2*1H4;
InChIKeyNDIVGMYREISXJR-UHFFFAOYSA-N
MW355.33 g/mol
LogP1.39
Rot. Bonds10

About 1-[2-[1-(2-aminopropoxy)propan-2-yloxy]ethoxy]propan-2-amine;methane;yttrium

1-[2-[1-(2-aminopropoxy)propan-2-yloxy]ethoxy]propan-2-amine;methane;yttrium (PubChem CID 159748487) has the molecular formula C13H34N2O3Y and a molecular weight of 355.33 g/mol. Its IUPAC name is 1-[2-[1-(2-aminopropoxy)propan-2-yloxy]ethoxy]propan-2-amine;methane;yttrium.

Molecular Properties

Compound Name1-[2-[1-(2-aminopropoxy)propan-2-yloxy]ethoxy]propan-2-amine;methane;yttrium
PubChem CID159748487
Molecular FormulaC13H34N2O3Y
Molecular Weight355.33 g/mol
Exact Mass355.16
IUPAC Name1-[2-[1-(2-aminopropoxy)propan-2-yloxy]ethoxy]propan-2-amine;methane;yttrium
SMILESC.C.CC(N)COCCOC(C)COCC(C)N.[Y]
InChIInChI=1S/C11H26N2O3.2CH4.Y/c1-9(12)6-14-4-5-16-11(3)8-15-7-10(2)13;;;/h9-11H,4-8,12-13H2,1-3H3;2*1H4;
InChIKeyNDIVGMYREISXJR-UHFFFAOYSA-N
XLogP1.39
TPSA79.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.33
LogP ≤ 51.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-[2-[2-(2-aminopropoxy)propoxy]ethoxy]propan-1-amine
CID 58898571
1-[4-[2-(2-aminopropoxy)propoxy]butoxy]propan-2-amine;azane;methane;yttrium
CID 159274573
1-[2-(1-aminoethoxy)ethoxy]propan-2-amine
CID 153419048
1-[2-[2-(4-cyclopropyl-2-methylbutoxy)ethoxy]propoxy]propan-2-amine
CID 165054791
1-[1-[2-[1-(2-aminopropoxy)propan-2-yloxy]ethoxy]propan-2-ylamino]propan-2-ol
CID 59847764
1-[2-[1-[2-[2-[1-(2-aminopropoxy)propan-2-yloxy]propoxy]propoxy]propan-2-yloxy]propoxy]propan-2-amine
CID 129028378
(2R)-1-[(2R)-1-[(2R)-1-(2-methoxyethoxy)propan-2-yl]oxypropan-2-yl]oxypropan-2-amine
CID 157049295
1-[1-[2-(2-amino-2-chloroethoxy)ethoxy]propan-2-yloxy]propan-2-amine
CID 59972165
(2S)-1-[2-(2-methylpropoxy)ethoxy]propan-2-amine
CID 106447202
2-propoxy-1-[2-(2-propoxypropoxy)ethoxy]propane
CID 87065837
6-[2-[2-(2-aminopropoxy)ethoxy]propoxy]-5-methyl-1-(3-trihydroxysilylpropoxy)hexan-2-ol
CID 165048221
(2S)-1-[2-(2-methoxyethoxy)ethoxy]propan-2-amine
CID 104560725

Frequently Asked Questions

What is the IUPAC name of 1-[2-[1-(2-aminopropoxy)propan-2-yloxy]ethoxy]propan-2-amine;methane;yttrium?
The IUPAC name of 1-[2-[1-(2-aminopropoxy)propan-2-yloxy]ethoxy]propan-2-amine;methane;yttrium (CID 159748487) is 1-[2-[1-(2-aminopropoxy)propan-2-yloxy]ethoxy]propan-2-amine;methane;yttrium.
What is the SMILES notation for 1-[2-[1-(2-aminopropoxy)propan-2-yloxy]ethoxy]propan-2-amine;methane;yttrium?
The canonical SMILES for 1-[2-[1-(2-aminopropoxy)propan-2-yloxy]ethoxy]propan-2-amine;methane;yttrium is C.C.CC(N)COCCOC(C)COCC(C)N.[Y].
What is the InChIKey of 1-[2-[1-(2-aminopropoxy)propan-2-yloxy]ethoxy]propan-2-amine;methane;yttrium?
The InChIKey is NDIVGMYREISXJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H26N2O3.2CH4.Y/c1-9(12)6-14-4-5-16-11(3)8-15-7-10(2)13;;;/h9-11H,4-8,12-13H2,1-3H3;2*1H4;.
What are the key properties of 1-[2-[1-(2-aminopropoxy)propan-2-yloxy]ethoxy]propan-2-amine;methane;yttrium?
1-[2-[1-(2-aminopropoxy)propan-2-yloxy]ethoxy]propan-2-amine;methane;yttrium has a molecular weight of 355.33 g/mol, XLogP of 1.39, 10 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[1-(2-aminopropoxy)propan-2-yloxy]ethoxy]propan-2-amine;methane;yttrium is sourced from PubChem (CID 159748487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).