N-[[3-[3-(2-methoxyethoxy)propoxy]-4-pyridinyl]methyl]ethanamine

C14H24N2O3 — CID 103405777

IUPACN-[[3-[3-(2-methoxyethoxy)propoxy]-4-pyridinyl]methyl]ethanamine
SMILESCCNCc1ccncc1OCCCOCCOC
InChIInChI=1S/C14H24N2O3/c1-3-15-11-13-5-6-16-12-14(13)19-8-4-7-18-10-9-17-2/h5-6,12,15H,3-4,7-11H2,1-2H3
InChIKeyJTMYWJPHHUVXJR-UHFFFAOYSA-N
MW268.36 g/mol
LogP1.62
Rot. Bonds11

About N-[[3-[3-(2-methoxyethoxy)propoxy]-4-pyridinyl]methyl]ethanamine

N-[[3-[3-(2-methoxyethoxy)propoxy]-4-pyridinyl]methyl]ethanamine (PubChem CID 103405777) has the molecular formula C14H24N2O3 and a molecular weight of 268.36 g/mol. Its IUPAC name is N-[[3-[3-(2-methoxyethoxy)propoxy]-4-pyridinyl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[3-[3-(2-methoxyethoxy)propoxy]-4-pyridinyl]methyl]ethanamine
PubChem CID103405777
Molecular FormulaC14H24N2O3
Molecular Weight268.36 g/mol
Exact Mass268.18
IUPAC NameN-[[3-[3-(2-methoxyethoxy)propoxy]-4-pyridinyl]methyl]ethanamine
SMILESCCNCc1ccncc1OCCCOCCOC
InChIInChI=1S/C14H24N2O3/c1-3-15-11-13-5-6-16-12-14(13)19-8-4-7-18-10-9-17-2/h5-6,12,15H,3-4,7-11H2,1-2H3
InChIKeyJTMYWJPHHUVXJR-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-[[3-(2-ethoxyethoxy)-4-pyridinyl]methyl]ethanamine
CID 105074911
N-[[3-(2-butoxyethoxy)-4-pyridinyl]methyl]propan-1-amine
CID 105075013
[3-[2-(3-methoxypropoxy)ethoxy]-4-pyridinyl]methanamine
CID 103176702
N-[[3-(2-phenoxyethoxy)-4-pyridinyl]methyl]ethanamine
CID 105074999
N-[[2-[3-(2-methoxyethoxy)propoxy]-3-pyridinyl]methyl]ethanamine
CID 103405698
N-[[3-[2-(1-methylpyrrolidin-2-yl)ethoxy]-4-pyridinyl]methyl]ethanamine
CID 105075391
N-[[4-[3-(2-methoxyethoxy)propoxy]-3-pyridinyl]methyl]-2-methylpropan-2-amine
CID 103405855
N-[[3-(2-ethoxyethoxy)-4-pyridinyl]methyl]propan-1-amine
CID 105074907
N-[[4-[3-(2-methoxyethoxy)propoxy]-3-pyridinyl]methyl]cyclopropanamine
CID 103405852
N-[[5-methoxy-2-[2-(3-methoxypropoxy)ethoxy]phenyl]methyl]ethanamine
CID 103177499
N-[(4-hexoxy-3-pyridinyl)methyl]ethanamine
CID 81255386
N-[[3-(2-methylpentoxy)-4-pyridinyl]methyl]ethanamine
CID 103285372

Frequently Asked Questions

What is the IUPAC name of N-[[3-[3-(2-methoxyethoxy)propoxy]-4-pyridinyl]methyl]ethanamine?
The IUPAC name of N-[[3-[3-(2-methoxyethoxy)propoxy]-4-pyridinyl]methyl]ethanamine (CID 103405777) is N-[[3-[3-(2-methoxyethoxy)propoxy]-4-pyridinyl]methyl]ethanamine.
What is the SMILES notation for N-[[3-[3-(2-methoxyethoxy)propoxy]-4-pyridinyl]methyl]ethanamine?
The canonical SMILES for N-[[3-[3-(2-methoxyethoxy)propoxy]-4-pyridinyl]methyl]ethanamine is CCNCc1ccncc1OCCCOCCOC.
What is the InChIKey of N-[[3-[3-(2-methoxyethoxy)propoxy]-4-pyridinyl]methyl]ethanamine?
The InChIKey is JTMYWJPHHUVXJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O3/c1-3-15-11-13-5-6-16-12-14(13)19-8-4-7-18-10-9-17-2/h5-6,12,15H,3-4,7-11H2,1-2H3.
What are the key properties of N-[[3-[3-(2-methoxyethoxy)propoxy]-4-pyridinyl]methyl]ethanamine?
N-[[3-[3-(2-methoxyethoxy)propoxy]-4-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-[[3-[3-(2-methoxyethoxy)propoxy]-4-pyridinyl]methyl]ethanamine is sourced from PubChem (CID 103405777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).