N-[3-[2-(2-butoxyethoxy)ethoxy]propyl]-2-methylpropan-2-amine

C15H33NO3 — CID 89274543

IUPACN-[3-[2-(2-butoxyethoxy)ethoxy]propyl]-2-methylpropan-2-amine
SMILESCCCCOCCOCCOCCCNC(C)(C)C
InChIInChI=1S/C15H33NO3/c1-5-6-9-17-11-13-19-14-12-18-10-7-8-16-15(2,3)4/h16H,5-14H2,1-4H3
InChIKeyCUEFZHXXDQLDPT-UHFFFAOYSA-N
MW275.43 g/mol
LogP2.61
Rot. Bonds13

About N-[3-[2-(2-butoxyethoxy)ethoxy]propyl]-2-methylpropan-2-amine

N-[3-[2-(2-butoxyethoxy)ethoxy]propyl]-2-methylpropan-2-amine (PubChem CID 89274543) has the molecular formula C15H33NO3 and a molecular weight of 275.43 g/mol. Its IUPAC name is N-[3-[2-(2-butoxyethoxy)ethoxy]propyl]-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-[3-[2-(2-butoxyethoxy)ethoxy]propyl]-2-methylpropan-2-amine
PubChem CID89274543
Molecular FormulaC15H33NO3
Molecular Weight275.43 g/mol
Exact Mass275.25
IUPAC NameN-[3-[2-(2-butoxyethoxy)ethoxy]propyl]-2-methylpropan-2-amine
SMILESCCCCOCCOCCOCCCNC(C)(C)C
InChIInChI=1S/C15H33NO3/c1-5-6-9-17-11-13-19-14-12-18-10-7-8-16-15(2,3)4/h16H,5-14H2,1-4H3
InChIKeyCUEFZHXXDQLDPT-UHFFFAOYSA-N
XLogP2.61
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds13
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.43
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(2-butoxyethyl)-2-methylpropan-2-amine
CID 61483179
N-[3-[2-(2-ethoxyethoxy)ethoxy]propyl]-2-methylpropan-2-amine
CID 89274546
N-[3-(2-methoxyethoxy)propyl]-2-methylpropan-2-amine
CID 62455424
N-[3-(3-ethoxypropoxy)propyl]-2-methylpropan-2-amine
CID 155219490
N-[3-[3-(2-methoxyethoxy)propoxy]propyl]-2-methylpropan-2-amine
CID 103401793
N-[2-[3-[2-[2-(tert-butylamino)ethoxy]ethoxy]propoxy]ethyl]-2-methylpropan-2-amine
CID 129102277
2-[3-(tert-butylamino)propoxy]ethanol
CID 150900173
2-methyl-N-[2-[2-[2-(2-propoxyethoxy)ethoxy]ethoxy]ethyl]propan-2-amine
CID 138466955
3-[2-(2-butoxyethoxy)ethoxy]-N-ethylpropan-1-amine
CID 89283788
N-[2-[2-(tert-butylamino)ethoxy]ethyl]butan-1-amine
CID 149134271
N-tert-butyl-4-[3-(2-methoxyethoxy)propoxy]butan-1-amine
CID 103406524
N-[3-[3-(dimethylamino)propoxy]propyl]-2-methylpropan-2-amine
CID 62460782

Frequently Asked Questions

What is the IUPAC name of N-[3-[2-(2-butoxyethoxy)ethoxy]propyl]-2-methylpropan-2-amine?
The IUPAC name of N-[3-[2-(2-butoxyethoxy)ethoxy]propyl]-2-methylpropan-2-amine (CID 89274543) is N-[3-[2-(2-butoxyethoxy)ethoxy]propyl]-2-methylpropan-2-amine.
What is the SMILES notation for N-[3-[2-(2-butoxyethoxy)ethoxy]propyl]-2-methylpropan-2-amine?
The canonical SMILES for N-[3-[2-(2-butoxyethoxy)ethoxy]propyl]-2-methylpropan-2-amine is CCCCOCCOCCOCCCNC(C)(C)C.
What is the InChIKey of N-[3-[2-(2-butoxyethoxy)ethoxy]propyl]-2-methylpropan-2-amine?
The InChIKey is CUEFZHXXDQLDPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H33NO3/c1-5-6-9-17-11-13-19-14-12-18-10-7-8-16-15(2,3)4/h16H,5-14H2,1-4H3.
What are the key properties of N-[3-[2-(2-butoxyethoxy)ethoxy]propyl]-2-methylpropan-2-amine?
N-[3-[2-(2-butoxyethoxy)ethoxy]propyl]-2-methylpropan-2-amine has a molecular weight of 275.43 g/mol, XLogP of 2.61, 13 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[2-(2-butoxyethoxy)ethoxy]propyl]-2-methylpropan-2-amine is sourced from PubChem (CID 89274543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).