6-[2-(2-methoxyethoxy)ethoxymethyl]-N-propylpyridin-2-amine

C14H24N2O3 — CID 104565921

IUPAC6-[2-(2-methoxyethoxy)ethoxymethyl]-N-propylpyridin-2-amine
SMILESCCCNc1cccc(COCCOCCOC)n1
InChIInChI=1S/C14H24N2O3/c1-3-7-15-14-6-4-5-13(16-14)12-19-11-10-18-9-8-17-2/h4-6H,3,7-12H2,1-2H3,(H,15,16)
InChIKeyXBCJBAGDBKORRL-UHFFFAOYSA-N
MW268.36 g/mol
LogP2.08
Rot. Bonds11

About 6-[2-(2-methoxyethoxy)ethoxymethyl]-N-propylpyridin-2-amine

6-[2-(2-methoxyethoxy)ethoxymethyl]-N-propylpyridin-2-amine (PubChem CID 104565921) has the molecular formula C14H24N2O3 and a molecular weight of 268.36 g/mol. Its IUPAC name is 6-[2-(2-methoxyethoxy)ethoxymethyl]-N-propylpyridin-2-amine.

Molecular Properties

Compound Name6-[2-(2-methoxyethoxy)ethoxymethyl]-N-propylpyridin-2-amine
PubChem CID104565921
Molecular FormulaC14H24N2O3
Molecular Weight268.36 g/mol
Exact Mass268.18
IUPAC Name6-[2-(2-methoxyethoxy)ethoxymethyl]-N-propylpyridin-2-amine
SMILESCCCNc1cccc(COCCOCCOC)n1
InChIInChI=1S/C14H24N2O3/c1-3-7-15-14-6-4-5-13(16-14)12-19-11-10-18-9-8-17-2/h4-6H,3,7-12H2,1-2H3,(H,15,16)
InChIKeyXBCJBAGDBKORRL-UHFFFAOYSA-N
XLogP2.08
TPSA52.61 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds11
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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-(2-methoxyethoxy)ethoxymethyl]-N-propylpyridin-2-amine?
The IUPAC name of 6-[2-(2-methoxyethoxy)ethoxymethyl]-N-propylpyridin-2-amine (CID 104565921) is 6-[2-(2-methoxyethoxy)ethoxymethyl]-N-propylpyridin-2-amine.
What is the SMILES notation for 6-[2-(2-methoxyethoxy)ethoxymethyl]-N-propylpyridin-2-amine?
The canonical SMILES for 6-[2-(2-methoxyethoxy)ethoxymethyl]-N-propylpyridin-2-amine is CCCNc1cccc(COCCOCCOC)n1.
What is the InChIKey of 6-[2-(2-methoxyethoxy)ethoxymethyl]-N-propylpyridin-2-amine?
The InChIKey is XBCJBAGDBKORRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O3/c1-3-7-15-14-6-4-5-13(16-14)12-19-11-10-18-9-8-17-2/h4-6H,3,7-12H2,1-2H3,(H,15,16).
What are the key properties of 6-[2-(2-methoxyethoxy)ethoxymethyl]-N-propylpyridin-2-amine?
6-[2-(2-methoxyethoxy)ethoxymethyl]-N-propylpyridin-2-amine has a molecular weight of 268.36 g/mol, XLogP of 2.08, 11 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(2-methoxyethoxy)ethoxymethyl]-N-propylpyridin-2-amine is sourced from PubChem (CID 104565921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).