(Z)-1-[amino-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]amino]prop-1-en-2-amine

C11H25N3O3 — CID 169106552

IUPAC(Z)-1-[amino-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]amino]prop-1-en-2-amine
SMILESCCOCCOCCOCCN(N)/C=C(/C)N
InChIInChI=1S/C11H25N3O3/c1-3-15-6-7-17-9-8-16-5-4-14(13)10-11(2)12/h10H,3-9,12-13H2,1-2H3/b11-10-
InChIKeyYJCXPJUDZMCOMO-KHPPLWFESA-N
MW247.34 g/mol
LogP0.05
Rot. Bonds11

About (Z)-1-[amino-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]amino]prop-1-en-2-amine

(Z)-1-[amino-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]amino]prop-1-en-2-amine (PubChem CID 169106552) has the molecular formula C11H25N3O3 and a molecular weight of 247.34 g/mol. Its IUPAC name is (Z)-1-[amino-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]amino]prop-1-en-2-amine.

Molecular Properties

Compound Name(Z)-1-[amino-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]amino]prop-1-en-2-amine
PubChem CID169106552
Molecular FormulaC11H25N3O3
Molecular Weight247.34 g/mol
Exact Mass247.19
IUPAC Name(Z)-1-[amino-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]amino]prop-1-en-2-amine
SMILESCCOCCOCCOCCN(N)/C=C(/C)N
InChIInChI=1S/C11H25N3O3/c1-3-15-6-7-17-9-8-16-5-4-14(13)10-11(2)12/h10H,3-9,12-13H2,1-2H3/b11-10-
InChIKeyYJCXPJUDZMCOMO-KHPPLWFESA-N
XLogP0.05
TPSA82.97 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds11
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 50.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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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Related Compounds

(Z)-1-[amino-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl]amino]prop-1-en-2-amine
CID 130458419
(Z)-1-[amino-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]amino]prop-1-en-2-amine
CID 130458447
3-[2-[2-[2-(2-Methoxyethoxy)ethoxy]ethoxy]ethyl]-5-methyl-1,2-dihydrotriazole
CID 130458448
(Z)-1-[amino-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]amino]prop-1-en-2-amine;ethane
CID 144004090
acetaldehyde;(Z)-1-[amino-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]amino]prop-1-en-2-amine;ethane
CID 144268432
2-[amino-[(Z)-2-amino-3-ethoxyprop-1-enyl]amino]ethanol;ethane
CID 144584893
(Z)-1-[amino(2-prop-2-enoxyethyl)amino]-3-methoxyprop-1-en-2-amine;methoxyethane;prop-1-ene
CID 145160419
2-hydrazinyl-N-[2-(2-methoxyethoxy)ethyl]buta-1,3-dien-1-amine
CID 145229984
(Z)-1-[amino(2-methoxyethyl)amino]but-1-en-2-amine
CID 145256992
(Z)-1-[amino-[2-[2-[2-[2-[2-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]amino]but-1-en-2-amine;ethane
CID 145396347
(Z)-2-amino-3-[amino-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]amino]prop-2-en-1-ol;ethane
CID 145396356
(Z)-2-amino-3-[amino-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]amino]prop-2-en-1-ol;ethane
CID 145396407

Frequently Asked Questions

What is the IUPAC name of (Z)-1-[amino-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]amino]prop-1-en-2-amine?
The IUPAC name of (Z)-1-[amino-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]amino]prop-1-en-2-amine (CID 169106552) is (Z)-1-[amino-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]amino]prop-1-en-2-amine.
What is the SMILES notation for (Z)-1-[amino-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]amino]prop-1-en-2-amine?
The canonical SMILES for (Z)-1-[amino-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]amino]prop-1-en-2-amine is CCOCCOCCOCCN(N)/C=C(/C)N.
What is the InChIKey of (Z)-1-[amino-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]amino]prop-1-en-2-amine?
The InChIKey is YJCXPJUDZMCOMO-KHPPLWFESA-N. The full InChI is InChI=1S/C11H25N3O3/c1-3-15-6-7-17-9-8-16-5-4-14(13)10-11(2)12/h10H,3-9,12-13H2,1-2H3/b11-10-.
What are the key properties of (Z)-1-[amino-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]amino]prop-1-en-2-amine?
(Z)-1-[amino-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]amino]prop-1-en-2-amine has a molecular weight of 247.34 g/mol, XLogP of 0.05, 11 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-[amino-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]amino]prop-1-en-2-amine is sourced from PubChem (CID 169106552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).