N-[[6-[3-(2-methoxyethoxy)propoxy]-2-pyridinyl]methyl]ethanamine

C14H24N2O3 — CID 103405635

IUPACN-[[6-[3-(2-methoxyethoxy)propoxy]-2-pyridinyl]methyl]ethanamine
SMILESCCNCc1cccc(OCCCOCCOC)n1
InChIInChI=1S/C14H24N2O3/c1-3-15-12-13-6-4-7-14(16-13)19-9-5-8-18-11-10-17-2/h4,6-7,15H,3,5,8-12H2,1-2H3
InChIKeySKORMSQBRXCPII-UHFFFAOYSA-N
MW268.36 g/mol
LogP1.62
Rot. Bonds11

About N-[[6-[3-(2-methoxyethoxy)propoxy]-2-pyridinyl]methyl]ethanamine

N-[[6-[3-(2-methoxyethoxy)propoxy]-2-pyridinyl]methyl]ethanamine (PubChem CID 103405635) has the molecular formula C14H24N2O3 and a molecular weight of 268.36 g/mol. Its IUPAC name is N-[[6-[3-(2-methoxyethoxy)propoxy]-2-pyridinyl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[6-[3-(2-methoxyethoxy)propoxy]-2-pyridinyl]methyl]ethanamine
PubChem CID103405635
Molecular FormulaC14H24N2O3
Molecular Weight268.36 g/mol
Exact Mass268.18
IUPAC NameN-[[6-[3-(2-methoxyethoxy)propoxy]-2-pyridinyl]methyl]ethanamine
SMILESCCNCc1cccc(OCCCOCCOC)n1
InChIInChI=1S/C14H24N2O3/c1-3-15-12-13-6-4-7-14(16-13)19-9-5-8-18-11-10-17-2/h4,6-7,15H,3,5,8-12H2,1-2H3
InChIKeySKORMSQBRXCPII-UHFFFAOYSA-N
XLogP1.62
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 ≤ 51.62
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 N-[[6-[3-(2-methoxyethoxy)propoxy]-2-pyridinyl]methyl]ethanamine?
The IUPAC name of N-[[6-[3-(2-methoxyethoxy)propoxy]-2-pyridinyl]methyl]ethanamine (CID 103405635) is N-[[6-[3-(2-methoxyethoxy)propoxy]-2-pyridinyl]methyl]ethanamine.
What is the SMILES notation for N-[[6-[3-(2-methoxyethoxy)propoxy]-2-pyridinyl]methyl]ethanamine?
The canonical SMILES for N-[[6-[3-(2-methoxyethoxy)propoxy]-2-pyridinyl]methyl]ethanamine is CCNCc1cccc(OCCCOCCOC)n1.
What is the InChIKey of N-[[6-[3-(2-methoxyethoxy)propoxy]-2-pyridinyl]methyl]ethanamine?
The InChIKey is SKORMSQBRXCPII-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O3/c1-3-15-12-13-6-4-7-14(16-13)19-9-5-8-18-11-10-17-2/h4,6-7,15H,3,5,8-12H2,1-2H3.
What are the key properties of N-[[6-[3-(2-methoxyethoxy)propoxy]-2-pyridinyl]methyl]ethanamine?
N-[[6-[3-(2-methoxyethoxy)propoxy]-2-pyridinyl]methyl]ethanamine has a molecular weight of 268.36 g/mol, XLogP of 1.62, 11 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[6-[3-(2-methoxyethoxy)propoxy]-2-pyridinyl]methyl]ethanamine is sourced from PubChem (CID 103405635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).