(Z)-2-amino-3-[2-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethoxy]ethylamino]prop-2-en-1-ol;ethane

C19H44N2O6 — CID 145396381

IUPAC(Z)-2-amino-3-[2-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethoxy]ethylamino]prop-2-en-1-ol;ethane
SMILESCC.CC.CCOCCOCCOCCOCCOCCN/C=C(\N)CO
InChIInChI=1S/C15H32N2O6.2C2H6/c1-2-19-5-6-21-9-10-23-12-11-22-8-7-20-4-3-17-13-15(16)14-18;2*1-2/h13,17-18H,2-12,14,16H2,1H3;2*1-2H3/b15-13-;;
InChIKeyCEFQRZXXQQFRPU-FQGJLALVSA-N
MW396.57 g/mol
LogP1.52
Rot. Bonds18

About (Z)-2-amino-3-[2-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethoxy]ethylamino]prop-2-en-1-ol;ethane

(Z)-2-amino-3-[2-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethoxy]ethylamino]prop-2-en-1-ol;ethane (PubChem CID 145396381) has the molecular formula C19H44N2O6 and a molecular weight of 396.57 g/mol. Its IUPAC name is (Z)-2-amino-3-[2-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethoxy]ethylamino]prop-2-en-1-ol;ethane.

Molecular Properties

Compound Name(Z)-2-amino-3-[2-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethoxy]ethylamino]prop-2-en-1-ol;ethane
PubChem CID145396381
Molecular FormulaC19H44N2O6
Molecular Weight396.57 g/mol
Exact Mass396.32
IUPAC Name(Z)-2-amino-3-[2-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethoxy]ethylamino]prop-2-en-1-ol;ethane
SMILESCC.CC.CCOCCOCCOCCOCCOCCN/C=C(\N)CO
InChIInChI=1S/C15H32N2O6.2C2H6/c1-2-19-5-6-21-9-10-23-12-11-22-8-7-20-4-3-17-13-15(16)14-18;2*1-2/h13,17-18H,2-12,14,16H2,1H3;2*1-2H3/b15-13-;;
InChIKeyCEFQRZXXQQFRPU-FQGJLALVSA-N
XLogP1.52
TPSA104.43 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds18
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.57
LogP ≤ 51.52
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

Analyze (Z)-2-amino-3-[2-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethoxy]ethylamino]prop-2-en-1-ol;ethane with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (Z)-2-amino-3-[2-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethoxy]ethylamino]prop-2-en-1-ol;ethane?
The IUPAC name of (Z)-2-amino-3-[2-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethoxy]ethylamino]prop-2-en-1-ol;ethane (CID 145396381) is (Z)-2-amino-3-[2-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethoxy]ethylamino]prop-2-en-1-ol;ethane.
What is the SMILES notation for (Z)-2-amino-3-[2-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethoxy]ethylamino]prop-2-en-1-ol;ethane?
The canonical SMILES for (Z)-2-amino-3-[2-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethoxy]ethylamino]prop-2-en-1-ol;ethane is CC.CC.CCOCCOCCOCCOCCOCCN/C=C(\N)CO.
What is the InChIKey of (Z)-2-amino-3-[2-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethoxy]ethylamino]prop-2-en-1-ol;ethane?
The InChIKey is CEFQRZXXQQFRPU-FQGJLALVSA-N. The full InChI is InChI=1S/C15H32N2O6.2C2H6/c1-2-19-5-6-21-9-10-23-12-11-22-8-7-20-4-3-17-13-15(16)14-18;2*1-2/h13,17-18H,2-12,14,16H2,1H3;2*1-2H3/b15-13-;;.
What are the key properties of (Z)-2-amino-3-[2-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethoxy]ethylamino]prop-2-en-1-ol;ethane?
(Z)-2-amino-3-[2-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethoxy]ethylamino]prop-2-en-1-ol;ethane has a molecular weight of 396.57 g/mol, XLogP of 1.52, 18 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-amino-3-[2-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethoxy]ethylamino]prop-2-en-1-ol;ethane is sourced from PubChem (CID 145396381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).