(Z)-2-amino-3-[amino-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl]amino]prop-2-en-1-ol

C11H26N4O4 — CID 134414565

IUPAC(Z)-2-amino-3-[amino-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl]amino]prop-2-en-1-ol
SMILESNCCOCCOCCOCCN(N)/C=C(\N)CO
InChIInChI=1S/C11H26N4O4/c12-1-3-17-5-7-19-8-6-18-4-2-15(14)9-11(13)10-16/h9,16H,1-8,10,12-14H2/b11-9-
InChIKeyDFQACQGEQFXXJB-LUAWRHEFSA-N
MW278.35 g/mol
LogP-2.04
Rot. Bonds13

About (Z)-2-amino-3-[amino-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl]amino]prop-2-en-1-ol

(Z)-2-amino-3-[amino-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl]amino]prop-2-en-1-ol (PubChem CID 134414565) has the molecular formula C11H26N4O4 and a molecular weight of 278.35 g/mol. Its IUPAC name is (Z)-2-amino-3-[amino-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl]amino]prop-2-en-1-ol.

Molecular Properties

Compound Name(Z)-2-amino-3-[amino-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl]amino]prop-2-en-1-ol
PubChem CID134414565
Molecular FormulaC11H26N4O4
Molecular Weight278.35 g/mol
Exact Mass278.20
IUPAC Name(Z)-2-amino-3-[amino-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl]amino]prop-2-en-1-ol
SMILESNCCOCCOCCOCCN(N)/C=C(\N)CO
InChIInChI=1S/C11H26N4O4/c12-1-3-17-5-7-19-8-6-18-4-2-15(14)9-11(13)10-16/h9,16H,1-8,10,12-14H2/b11-9-
InChIKeyDFQACQGEQFXXJB-LUAWRHEFSA-N
XLogP-2.04
TPSA129.22 Ų
H-Bond Donors4
H-Bond Acceptors8
Rotatable Bonds13
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.35
LogP ≤ 5-2.04
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (Z)-2-amino-3-[amino-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl]amino]prop-2-en-1-ol?
The IUPAC name of (Z)-2-amino-3-[amino-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl]amino]prop-2-en-1-ol (CID 134414565) is (Z)-2-amino-3-[amino-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl]amino]prop-2-en-1-ol.
What is the SMILES notation for (Z)-2-amino-3-[amino-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl]amino]prop-2-en-1-ol?
The canonical SMILES for (Z)-2-amino-3-[amino-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl]amino]prop-2-en-1-ol is NCCOCCOCCOCCN(N)/C=C(\N)CO.
What is the InChIKey of (Z)-2-amino-3-[amino-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl]amino]prop-2-en-1-ol?
The InChIKey is DFQACQGEQFXXJB-LUAWRHEFSA-N. The full InChI is InChI=1S/C11H26N4O4/c12-1-3-17-5-7-19-8-6-18-4-2-15(14)9-11(13)10-16/h9,16H,1-8,10,12-14H2/b11-9-.
What are the key properties of (Z)-2-amino-3-[amino-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl]amino]prop-2-en-1-ol?
(Z)-2-amino-3-[amino-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl]amino]prop-2-en-1-ol has a molecular weight of 278.35 g/mol, XLogP of -2.04, 13 rotatable bonds, 4 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-amino-3-[amino-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl]amino]prop-2-en-1-ol is sourced from PubChem (CID 134414565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).