N-[2-[2-(1-methoxyethoxy)ethoxy]ethyl]-2-methylpropan-2-amine

C11H25NO3 — CID 175013035

IUPACN-[2-[2-(1-methoxyethoxy)ethoxy]ethyl]-2-methylpropan-2-amine
SMILESCOC(C)OCCOCCNC(C)(C)C
InChIInChI=1S/C11H25NO3/c1-10(13-5)15-9-8-14-7-6-12-11(2,3)4/h10,12H,6-9H2,1-5H3
InChIKeyISNRPXQZMFJKGR-UHFFFAOYSA-N
MW219.32 g/mol
LogP1.40
Rot. Bonds8

About N-[2-[2-(1-methoxyethoxy)ethoxy]ethyl]-2-methylpropan-2-amine

N-[2-[2-(1-methoxyethoxy)ethoxy]ethyl]-2-methylpropan-2-amine (PubChem CID 175013035) has the molecular formula C11H25NO3 and a molecular weight of 219.32 g/mol. Its IUPAC name is N-[2-[2-(1-methoxyethoxy)ethoxy]ethyl]-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-[2-[2-(1-methoxyethoxy)ethoxy]ethyl]-2-methylpropan-2-amine
PubChem CID175013035
Molecular FormulaC11H25NO3
Molecular Weight219.32 g/mol
Exact Mass219.18
IUPAC NameN-[2-[2-(1-methoxyethoxy)ethoxy]ethyl]-2-methylpropan-2-amine
SMILESCOC(C)OCCOCCNC(C)(C)C
InChIInChI=1S/C11H25NO3/c1-10(13-5)15-9-8-14-7-6-12-11(2,3)4/h10,12H,6-9H2,1-5H3
InChIKeyISNRPXQZMFJKGR-UHFFFAOYSA-N
XLogP1.40
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.32
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[2-[2-(1-methoxyethoxy)ethoxy]ethyl]-2-methylpropan-2-amine?
The IUPAC name of N-[2-[2-(1-methoxyethoxy)ethoxy]ethyl]-2-methylpropan-2-amine (CID 175013035) is N-[2-[2-(1-methoxyethoxy)ethoxy]ethyl]-2-methylpropan-2-amine.
What is the SMILES notation for N-[2-[2-(1-methoxyethoxy)ethoxy]ethyl]-2-methylpropan-2-amine?
The canonical SMILES for N-[2-[2-(1-methoxyethoxy)ethoxy]ethyl]-2-methylpropan-2-amine is COC(C)OCCOCCNC(C)(C)C.
What is the InChIKey of N-[2-[2-(1-methoxyethoxy)ethoxy]ethyl]-2-methylpropan-2-amine?
The InChIKey is ISNRPXQZMFJKGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25NO3/c1-10(13-5)15-9-8-14-7-6-12-11(2,3)4/h10,12H,6-9H2,1-5H3.
What are the key properties of N-[2-[2-(1-methoxyethoxy)ethoxy]ethyl]-2-methylpropan-2-amine?
N-[2-[2-(1-methoxyethoxy)ethoxy]ethyl]-2-methylpropan-2-amine has a molecular weight of 219.32 g/mol, XLogP of 1.40, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-(1-methoxyethoxy)ethoxy]ethyl]-2-methylpropan-2-amine is sourced from PubChem (CID 175013035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).