(Z)-N-[2-(2-aminoethoxy)ethyl]hex-3-enamide

C10H20N2O2 — CID 168852483

IUPAC(Z)-N-[2-(2-aminoethoxy)ethyl]hex-3-enamide
SMILESCC/C=C\CC(=O)NCCOCCN
InChIInChI=1S/C10H20N2O2/c1-2-3-4-5-10(13)12-7-9-14-8-6-11/h3-4H,2,5-9,11H2,1H3,(H,12,13)/b4-3-
InChIKeyYWEQBDISOIODAM-ARJAWSKDSA-N
MW200.28 g/mol
LogP0.43
Rot. Bonds8

About (Z)-N-[2-(2-aminoethoxy)ethyl]hex-3-enamide

(Z)-N-[2-(2-aminoethoxy)ethyl]hex-3-enamide (PubChem CID 168852483) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is (Z)-N-[2-(2-aminoethoxy)ethyl]hex-3-enamide.

Molecular Properties

Compound Name(Z)-N-[2-(2-aminoethoxy)ethyl]hex-3-enamide
PubChem CID168852483
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Name(Z)-N-[2-(2-aminoethoxy)ethyl]hex-3-enamide
SMILESCC/C=C\CC(=O)NCCOCCN
InChIInChI=1S/C10H20N2O2/c1-2-3-4-5-10(13)12-7-9-14-8-6-11/h3-4H,2,5-9,11H2,1H3,(H,12,13)/b4-3-
InChIKeyYWEQBDISOIODAM-ARJAWSKDSA-N
XLogP0.43
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 50.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(4Z,7Z,10Z,13Z,16Z,19Z)-N-(2-methoxyethyl)docosa-4,7,10,13,16,19-hexaenamide
CID 90071169
(3Z,6Z,9Z,12Z,15Z)-N-(2-hydroxyethyl)octadeca-3,6,9,12,15-pentaenamide
CID 164458073
N-but-3-enyl-2-propoxyacetamide
CID 17780693
(4Z,7Z,10Z,13Z,16Z,19Z)-N-[2-[2-[[(5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoyl]amino]ethoxy]ethyl]docosa-4,7,10,13,16,19-hexaenamide
CID 53374183
(4Z,7Z,10Z,13Z,16Z,19Z)-N-[2-[2-[[(E)-but-2-enoyl]amino]ethoxy]ethyl]docosa-4,7,10,13,16,19-hexaenamide
CID 58348971
(Z)-N-[2-[2-[[(E)-but-2-enoyl]amino]ethoxy]ethyl]hex-3-enamide
CID 58348975
N-{2-[2-(2-Aminoethoxy)ethoxy]ethyl}pent-4-enamide
CID 58835579
(E)-N,N'-diethylhex-3-enediamide
CID 59102602
N-(2-methoxyethyl)but-3-enamide
CID 59327281
N-[2-(methylaminomethoxy)ethyl]hex-4-enamide
CID 60072520
N-[2-[2-(aminomethylperoxy)ethoxy]ethyl]hex-4-enamide
CID 60090252
N-[2-[(but-3-enoylamino)methoxy]ethyl]but-3-enamide
CID 60139077

Frequently Asked Questions

What is the IUPAC name of (Z)-N-[2-(2-aminoethoxy)ethyl]hex-3-enamide?
The IUPAC name of (Z)-N-[2-(2-aminoethoxy)ethyl]hex-3-enamide (CID 168852483) is (Z)-N-[2-(2-aminoethoxy)ethyl]hex-3-enamide.
What is the SMILES notation for (Z)-N-[2-(2-aminoethoxy)ethyl]hex-3-enamide?
The canonical SMILES for (Z)-N-[2-(2-aminoethoxy)ethyl]hex-3-enamide is CC/C=C\CC(=O)NCCOCCN.
What is the InChIKey of (Z)-N-[2-(2-aminoethoxy)ethyl]hex-3-enamide?
The InChIKey is YWEQBDISOIODAM-ARJAWSKDSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-2-3-4-5-10(13)12-7-9-14-8-6-11/h3-4H,2,5-9,11H2,1H3,(H,12,13)/b4-3-.
What are the key properties of (Z)-N-[2-(2-aminoethoxy)ethyl]hex-3-enamide?
(Z)-N-[2-(2-aminoethoxy)ethyl]hex-3-enamide has a molecular weight of 200.28 g/mol, XLogP of 0.43, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-[2-(2-aminoethoxy)ethyl]hex-3-enamide is sourced from PubChem (CID 168852483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).