1-(2-methoxyethoxy)-3-[2-methoxyethyl(3-methoxypropyl)amino]propan-2-ol

C13H29NO5 — CID 106991901

IUPAC1-(2-methoxyethoxy)-3-[2-methoxyethyl(3-methoxypropyl)amino]propan-2-ol
SMILESCOCCCN(CCOC)CC(O)COCCOC
InChIInChI=1S/C13H29NO5/c1-16-7-4-5-14(6-8-17-2)11-13(15)12-19-10-9-18-3/h13,15H,4-12H2,1-3H3
InChIKeyYXAJTMOCDUQMGL-UHFFFAOYSA-N
MW279.38 g/mol
LogP-0.00
Rot. Bonds14

About 1-(2-methoxyethoxy)-3-[2-methoxyethyl(3-methoxypropyl)amino]propan-2-ol

1-(2-methoxyethoxy)-3-[2-methoxyethyl(3-methoxypropyl)amino]propan-2-ol (PubChem CID 106991901) has the molecular formula C13H29NO5 and a molecular weight of 279.38 g/mol. Its IUPAC name is 1-(2-methoxyethoxy)-3-[2-methoxyethyl(3-methoxypropyl)amino]propan-2-ol.

Molecular Properties

Compound Name1-(2-methoxyethoxy)-3-[2-methoxyethyl(3-methoxypropyl)amino]propan-2-ol
PubChem CID106991901
Molecular FormulaC13H29NO5
Molecular Weight279.38 g/mol
Exact Mass279.20
IUPAC Name1-(2-methoxyethoxy)-3-[2-methoxyethyl(3-methoxypropyl)amino]propan-2-ol
SMILESCOCCCN(CCOC)CC(O)COCCOC
InChIInChI=1S/C13H29NO5/c1-16-7-4-5-14(6-8-17-2)11-13(15)12-19-10-9-18-3/h13,15H,4-12H2,1-3H3
InChIKeyYXAJTMOCDUQMGL-UHFFFAOYSA-N
XLogP-0.00
TPSA60.39 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds14
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 5-0.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 1-(2-methoxyethoxy)-3-[2-methoxyethyl(3-methoxypropyl)amino]propan-2-ol 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

1-[bis(2-methoxyethyl)amino]-3-butoxypropan-2-ol
CID 107263774
1-[2-methoxyethyl(3-methoxypropyl)amino]-3-propan-2-yloxypropan-2-ol
CID 61035306
1-[bis(2-methylpropyl)amino]-3-(2-methoxyethoxy)propan-2-ol
CID 106991798
1-[2-methoxyethyl(3-methoxypropyl)amino]-3-(propylamino)propan-2-ol
CID 54985437
(2R)-1-[bis(2-methoxyethyl)amino]-3-propan-2-yloxypropan-2-ol
CID 95357959
1-[bis(2-methoxyethyl)amino]-3-propan-2-yloxypropan-2-ol
CID 60635415
1-[bis(2-methoxyethyl)amino]-3-(1-methoxypropan-2-yloxy)propan-2-ol
CID 106991830
3-[bis(2-methoxyethyl)amino]propane-1,2-diol
CID 78907099
1-(2-methoxyethoxy)-3-[methyl(pentyl)amino]propan-2-ol
CID 106991621
1-methoxy-3-[3-(2-methoxyethoxy)propyl-methylamino]propan-2-ol
CID 103412009
1-[2-[2-[2-hydroxy-3-[[2-hydroxy-3-[2-[2-[2-hydroxy-3-[3-methoxypropyl(methyl)amino]propoxy]propoxy]propoxy]propyl]-(3-methoxypropyl)amino]propoxy]propoxy]propoxy]-3-[3-methoxypropyl(methyl)amino]propan-2-ol
CID 58399699
methyl 3-[2-methoxyethyl(3-methoxypropyl)amino]-2-methylpropanoate
CID 54989932

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethoxy)-3-[2-methoxyethyl(3-methoxypropyl)amino]propan-2-ol?
The IUPAC name of 1-(2-methoxyethoxy)-3-[2-methoxyethyl(3-methoxypropyl)amino]propan-2-ol (CID 106991901) is 1-(2-methoxyethoxy)-3-[2-methoxyethyl(3-methoxypropyl)amino]propan-2-ol.
What is the SMILES notation for 1-(2-methoxyethoxy)-3-[2-methoxyethyl(3-methoxypropyl)amino]propan-2-ol?
The canonical SMILES for 1-(2-methoxyethoxy)-3-[2-methoxyethyl(3-methoxypropyl)amino]propan-2-ol is COCCCN(CCOC)CC(O)COCCOC.
What is the InChIKey of 1-(2-methoxyethoxy)-3-[2-methoxyethyl(3-methoxypropyl)amino]propan-2-ol?
The InChIKey is YXAJTMOCDUQMGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H29NO5/c1-16-7-4-5-14(6-8-17-2)11-13(15)12-19-10-9-18-3/h13,15H,4-12H2,1-3H3.
What are the key properties of 1-(2-methoxyethoxy)-3-[2-methoxyethyl(3-methoxypropyl)amino]propan-2-ol?
1-(2-methoxyethoxy)-3-[2-methoxyethyl(3-methoxypropyl)amino]propan-2-ol has a molecular weight of 279.38 g/mol, XLogP of -0.00, 14 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethoxy)-3-[2-methoxyethyl(3-methoxypropyl)amino]propan-2-ol is sourced from PubChem (CID 106991901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).