N-[[4-[2-(3-methoxypropoxy)ethoxy]-2-pyridinyl]methyl]ethanamine

C14H24N2O3 — CID 103180865

IUPACN-[[4-[2-(3-methoxypropoxy)ethoxy]-2-pyridinyl]methyl]ethanamine
SMILESCCNCc1cc(OCCOCCCOC)ccn1
InChIInChI=1S/C14H24N2O3/c1-3-15-12-13-11-14(5-6-16-13)19-10-9-18-8-4-7-17-2/h5-6,11,15H,3-4,7-10,12H2,1-2H3
InChIKeyJHHRQMPMCBUTDV-UHFFFAOYSA-N
MW268.36 g/mol
LogP1.62
Rot. Bonds11

About N-[[4-[2-(3-methoxypropoxy)ethoxy]-2-pyridinyl]methyl]ethanamine

N-[[4-[2-(3-methoxypropoxy)ethoxy]-2-pyridinyl]methyl]ethanamine (PubChem CID 103180865) has the molecular formula C14H24N2O3 and a molecular weight of 268.36 g/mol. Its IUPAC name is N-[[4-[2-(3-methoxypropoxy)ethoxy]-2-pyridinyl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[4-[2-(3-methoxypropoxy)ethoxy]-2-pyridinyl]methyl]ethanamine
PubChem CID103180865
Molecular FormulaC14H24N2O3
Molecular Weight268.36 g/mol
Exact Mass268.18
IUPAC NameN-[[4-[2-(3-methoxypropoxy)ethoxy]-2-pyridinyl]methyl]ethanamine
SMILESCCNCc1cc(OCCOCCCOC)ccn1
InChIInChI=1S/C14H24N2O3/c1-3-15-12-13-11-14(5-6-16-13)19-10-9-18-8-4-7-17-2/h5-6,11,15H,3-4,7-10,12H2,1-2H3
InChIKeyJHHRQMPMCBUTDV-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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Related Compounds

N-[[4-[2-(2-methoxyethoxy)ethoxy]-2-pyridinyl]methyl]ethanamine
CID 104566339
1-[4-[2-(3-methoxypropoxy)ethoxy]-2-pyridinyl]-N-methylmethanamine
CID 103180750
N-[[4-(3-methoxypropoxy)-2-pyridinyl]methyl]propan-1-amine
CID 62288945
N-[[4-[2-(2-methoxyethoxy)ethoxy]-2-pyridinyl]methyl]-2-methylpropan-1-amine
CID 104566255
N-[[4-[2-(2-methoxyethoxy)ethoxy]-2-pyridinyl]methyl]propan-2-amine
CID 104566433
2-(chloromethyl)-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]pyridine
CID 113427169
N-[(4-prop-2-enoxy-2-pyridinyl)methyl]ethanamine
CID 62288081
N-[[5-methoxy-2-[2-(3-methoxypropoxy)ethoxy]phenyl]methyl]ethanamine
CID 103177499
2-chloro-4-[3-(2-methoxyethoxy)propoxy]pyridine
CID 103402231
N-[[3-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]methyl]ethanamine
CID 104560645
N-[[6-[3-(2-methoxyethoxy)propoxy]-2-pyridinyl]methyl]ethanamine
CID 103405635
[4-(2-methoxyethoxy)-2-pyridinyl]methanamine
CID 62292533

Frequently Asked Questions

What is the IUPAC name of N-[[4-[2-(3-methoxypropoxy)ethoxy]-2-pyridinyl]methyl]ethanamine?
The IUPAC name of N-[[4-[2-(3-methoxypropoxy)ethoxy]-2-pyridinyl]methyl]ethanamine (CID 103180865) is N-[[4-[2-(3-methoxypropoxy)ethoxy]-2-pyridinyl]methyl]ethanamine.
What is the SMILES notation for N-[[4-[2-(3-methoxypropoxy)ethoxy]-2-pyridinyl]methyl]ethanamine?
The canonical SMILES for N-[[4-[2-(3-methoxypropoxy)ethoxy]-2-pyridinyl]methyl]ethanamine is CCNCc1cc(OCCOCCCOC)ccn1.
What is the InChIKey of N-[[4-[2-(3-methoxypropoxy)ethoxy]-2-pyridinyl]methyl]ethanamine?
The InChIKey is JHHRQMPMCBUTDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O3/c1-3-15-12-13-11-14(5-6-16-13)19-10-9-18-8-4-7-17-2/h5-6,11,15H,3-4,7-10,12H2,1-2H3.
What are the key properties of N-[[4-[2-(3-methoxypropoxy)ethoxy]-2-pyridinyl]methyl]ethanamine?
N-[[4-[2-(3-methoxypropoxy)ethoxy]-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-[[4-[2-(3-methoxypropoxy)ethoxy]-2-pyridinyl]methyl]ethanamine is sourced from PubChem (CID 103180865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).