6-(2-methoxyethoxy)-3-methylhexan-2-amine

C10H23NO2 — CID 103410671

IUPAC6-(2-methoxyethoxy)-3-methylhexan-2-amine
SMILESCOCCOCCCC(C)C(C)N
InChIInChI=1S/C10H23NO2/c1-9(10(2)11)5-4-6-13-8-7-12-3/h9-10H,4-8,11H2,1-3H3
InChIKeyRRZMCOIAINWKJG-UHFFFAOYSA-N
MW189.30 g/mol
LogP1.41
Rot. Bonds8

About 6-(2-methoxyethoxy)-3-methylhexan-2-amine

6-(2-methoxyethoxy)-3-methylhexan-2-amine (PubChem CID 103410671) has the molecular formula C10H23NO2 and a molecular weight of 189.30 g/mol. Its IUPAC name is 6-(2-methoxyethoxy)-3-methylhexan-2-amine.

Molecular Properties

Compound Name6-(2-methoxyethoxy)-3-methylhexan-2-amine
PubChem CID103410671
Molecular FormulaC10H23NO2
Molecular Weight189.30 g/mol
Exact Mass189.17
IUPAC Name6-(2-methoxyethoxy)-3-methylhexan-2-amine
SMILESCOCCOCCCC(C)C(C)N
InChIInChI=1S/C10H23NO2/c1-9(10(2)11)5-4-6-13-8-7-12-3/h9-10H,4-8,11H2,1-3H3
InChIKeyRRZMCOIAINWKJG-UHFFFAOYSA-N
XLogP1.41
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.30
LogP ≤ 51.41
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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Frequently Asked Questions

What is the IUPAC name of 6-(2-methoxyethoxy)-3-methylhexan-2-amine?
The IUPAC name of 6-(2-methoxyethoxy)-3-methylhexan-2-amine (CID 103410671) is 6-(2-methoxyethoxy)-3-methylhexan-2-amine.
What is the SMILES notation for 6-(2-methoxyethoxy)-3-methylhexan-2-amine?
The canonical SMILES for 6-(2-methoxyethoxy)-3-methylhexan-2-amine is COCCOCCCC(C)C(C)N.
What is the InChIKey of 6-(2-methoxyethoxy)-3-methylhexan-2-amine?
The InChIKey is RRZMCOIAINWKJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NO2/c1-9(10(2)11)5-4-6-13-8-7-12-3/h9-10H,4-8,11H2,1-3H3.
What are the key properties of 6-(2-methoxyethoxy)-3-methylhexan-2-amine?
6-(2-methoxyethoxy)-3-methylhexan-2-amine has a molecular weight of 189.30 g/mol, XLogP of 1.41, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-methoxyethoxy)-3-methylhexan-2-amine is sourced from PubChem (CID 103410671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).