1-ethoxy-N-[2-(2-methylpropoxy)ethyl]propan-2-amine

C11H25NO2 — CID 115713728

IUPAC1-ethoxy-N-[2-(2-methylpropoxy)ethyl]propan-2-amine
SMILESCCOCC(C)NCCOCC(C)C
InChIInChI=1S/C11H25NO2/c1-5-13-9-11(4)12-6-7-14-8-10(2)3/h10-12H,5-9H2,1-4H3
InChIKeyAAGPOYUWKVLTGI-UHFFFAOYSA-N
MW203.33 g/mol
LogP1.67
Rot. Bonds9

About 1-ethoxy-N-[2-(2-methylpropoxy)ethyl]propan-2-amine

1-ethoxy-N-[2-(2-methylpropoxy)ethyl]propan-2-amine (PubChem CID 115713728) has the molecular formula C11H25NO2 and a molecular weight of 203.33 g/mol. Its IUPAC name is 1-ethoxy-N-[2-(2-methylpropoxy)ethyl]propan-2-amine.

Molecular Properties

Compound Name1-ethoxy-N-[2-(2-methylpropoxy)ethyl]propan-2-amine
PubChem CID115713728
Molecular FormulaC11H25NO2
Molecular Weight203.33 g/mol
Exact Mass203.19
IUPAC Name1-ethoxy-N-[2-(2-methylpropoxy)ethyl]propan-2-amine
SMILESCCOCC(C)NCCOCC(C)C
InChIInChI=1S/C11H25NO2/c1-5-13-9-11(4)12-6-7-14-8-10(2)3/h10-12H,5-9H2,1-4H3
InChIKeyAAGPOYUWKVLTGI-UHFFFAOYSA-N
XLogP1.67
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-methoxy-N-[2-[2-(2-methylpropoxy)ethoxy]ethyl]propan-2-amine
CID 106450224
N-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]-1-ethoxypropan-2-amine
CID 104562069
N-[2-(2-ethoxyethoxy)ethyl]butan-2-amine
CID 62565963
1-ethoxy-N-[3-(2-methoxyethoxy)propyl]propan-2-amine
CID 115707889
(E)-N-(1-ethoxypropan-2-yl)pent-3-en-1-amine
CID 115890248
1-ethoxy-2-methylpropane;1-propoxypropane
CID 174535854
N-[2-(2-methylpropoxy)ethyl]-1-piperidin-1-ylpropan-2-amine
CID 106451807
N-[3-(cyclopropylmethoxy)propyl]-1-ethoxypropan-2-amine
CID 115707824
1-methoxy-N-[2-(2-methylpropoxy)ethyl]pentan-2-amine
CID 106452067
N-(1-ethoxypropan-2-yl)-3-methoxy-3-methylbutan-1-amine
CID 103033262
N-[2-(2,2-difluoroethoxy)ethyl]butan-2-amine
CID 82009436
N-[2-(2,2-difluoroethoxy)ethyl]-4-methylpentan-2-amine
CID 103082762

Frequently Asked Questions

What is the IUPAC name of 1-ethoxy-N-[2-(2-methylpropoxy)ethyl]propan-2-amine?
The IUPAC name of 1-ethoxy-N-[2-(2-methylpropoxy)ethyl]propan-2-amine (CID 115713728) is 1-ethoxy-N-[2-(2-methylpropoxy)ethyl]propan-2-amine.
What is the SMILES notation for 1-ethoxy-N-[2-(2-methylpropoxy)ethyl]propan-2-amine?
The canonical SMILES for 1-ethoxy-N-[2-(2-methylpropoxy)ethyl]propan-2-amine is CCOCC(C)NCCOCC(C)C.
What is the InChIKey of 1-ethoxy-N-[2-(2-methylpropoxy)ethyl]propan-2-amine?
The InChIKey is AAGPOYUWKVLTGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25NO2/c1-5-13-9-11(4)12-6-7-14-8-10(2)3/h10-12H,5-9H2,1-4H3.
What are the key properties of 1-ethoxy-N-[2-(2-methylpropoxy)ethyl]propan-2-amine?
1-ethoxy-N-[2-(2-methylpropoxy)ethyl]propan-2-amine has a molecular weight of 203.33 g/mol, XLogP of 1.67, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethoxy-N-[2-(2-methylpropoxy)ethyl]propan-2-amine is sourced from PubChem (CID 115713728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).