1-[2-[[5-[2-(ethylamino)ethoxymethyl]-2-pyridinyl]methoxy]ethylamino]ethanol

C15H27N3O3 — CID 142623066

IUPAC1-[2-[[5-[2-(ethylamino)ethoxymethyl]-2-pyridinyl]methoxy]ethylamino]ethanol
SMILESCCNCCOCc1ccc(COCCNC(C)O)nc1
InChIInChI=1S/C15H27N3O3/c1-3-16-6-8-20-11-14-4-5-15(18-10-14)12-21-9-7-17-13(2)19/h4-5,10,13,16-17,19H,3,6-9,11-12H2,1-2H3
InChIKeyQGFHQASQAPGQJS-UHFFFAOYSA-N
MW297.40 g/mol
LogP0.65
Rot. Bonds12

About 1-[2-[[5-[2-(ethylamino)ethoxymethyl]-2-pyridinyl]methoxy]ethylamino]ethanol

1-[2-[[5-[2-(ethylamino)ethoxymethyl]-2-pyridinyl]methoxy]ethylamino]ethanol (PubChem CID 142623066) has the molecular formula C15H27N3O3 and a molecular weight of 297.40 g/mol. Its IUPAC name is 1-[2-[[5-[2-(ethylamino)ethoxymethyl]-2-pyridinyl]methoxy]ethylamino]ethanol.

Molecular Properties

Compound Name1-[2-[[5-[2-(ethylamino)ethoxymethyl]-2-pyridinyl]methoxy]ethylamino]ethanol
PubChem CID142623066
Molecular FormulaC15H27N3O3
Molecular Weight297.40 g/mol
Exact Mass297.21
IUPAC Name1-[2-[[5-[2-(ethylamino)ethoxymethyl]-2-pyridinyl]methoxy]ethylamino]ethanol
SMILESCCNCCOCc1ccc(COCCNC(C)O)nc1
InChIInChI=1S/C15H27N3O3/c1-3-16-6-8-20-11-14-4-5-15(18-10-14)12-21-9-7-17-13(2)19/h4-5,10,13,16-17,19H,3,6-9,11-12H2,1-2H3
InChIKeyQGFHQASQAPGQJS-UHFFFAOYSA-N
XLogP0.65
TPSA75.64 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds12
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 50.65
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Analyze 1-[2-[[5-[2-(ethylamino)ethoxymethyl]-2-pyridinyl]methoxy]ethylamino]ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[[6-[2-(2-methylpropoxy)ethoxymethyl]-3-pyridinyl]methyl]propan-1-amine
CID 106450090
2-[(4-bromophenyl)methoxy]-N-ethylethanamine
CID 62337818
2-methyl-N-[[6-(2-methylpentoxymethyl)-3-pyridinyl]methyl]propan-1-amine
CID 103285679
N-ethyl-2-[[4-(trifluoromethyl)phenyl]methoxy]ethanamine
CID 62337631
N-[[5-(ethoxymethyl)-2-pyridinyl]methyl]butan-1-amine
CID 143966477
2-(3,7-dimethyloct-6-enoxymethyl)-5-ethylpyridine
CID 54253350
N-[[6-(2,2-difluoroethoxymethyl)-3-pyridinyl]methyl]-2-methylpropan-1-amine
CID 82006767
N-[[6-[(1-methyl-1,2,4-triazol-3-yl)oxymethyl]-3-pyridinyl]methyl]ethanamine
CID 106598447
5-(ethylaminomethyl)-N-(1-methoxypropan-2-yl)-N-methylpyridin-2-amine
CID 62283072
N-ethyl-2-(imidazo[1,2-a]pyridin-2-ylmethoxy)ethanamine
CID 62336853
2-[(3,5-difluorophenyl)methoxy]-N-ethylethanamine
CID 105404471
N'-[(1R)-1-phenylethyl]-N-(2-phenylmethoxyethyl)ethane-1,2-diamine
CID 11850166

Frequently Asked Questions

What is the IUPAC name of 1-[2-[[5-[2-(ethylamino)ethoxymethyl]-2-pyridinyl]methoxy]ethylamino]ethanol?
The IUPAC name of 1-[2-[[5-[2-(ethylamino)ethoxymethyl]-2-pyridinyl]methoxy]ethylamino]ethanol (CID 142623066) is 1-[2-[[5-[2-(ethylamino)ethoxymethyl]-2-pyridinyl]methoxy]ethylamino]ethanol.
What is the SMILES notation for 1-[2-[[5-[2-(ethylamino)ethoxymethyl]-2-pyridinyl]methoxy]ethylamino]ethanol?
The canonical SMILES for 1-[2-[[5-[2-(ethylamino)ethoxymethyl]-2-pyridinyl]methoxy]ethylamino]ethanol is CCNCCOCc1ccc(COCCNC(C)O)nc1.
What is the InChIKey of 1-[2-[[5-[2-(ethylamino)ethoxymethyl]-2-pyridinyl]methoxy]ethylamino]ethanol?
The InChIKey is QGFHQASQAPGQJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O3/c1-3-16-6-8-20-11-14-4-5-15(18-10-14)12-21-9-7-17-13(2)19/h4-5,10,13,16-17,19H,3,6-9,11-12H2,1-2H3.
What are the key properties of 1-[2-[[5-[2-(ethylamino)ethoxymethyl]-2-pyridinyl]methoxy]ethylamino]ethanol?
1-[2-[[5-[2-(ethylamino)ethoxymethyl]-2-pyridinyl]methoxy]ethylamino]ethanol has a molecular weight of 297.40 g/mol, XLogP of 0.65, 12 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[[5-[2-(ethylamino)ethoxymethyl]-2-pyridinyl]methoxy]ethylamino]ethanol is sourced from PubChem (CID 142623066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).