17-amino-17-hydrazinylidene-N-[2-[2-(2-oxopropoxy)ethoxy]ethyl]heptadecanamide

C24H48N4O4 — CID 123710561

IUPAC17-amino-17-hydrazinylidene-N-[2-[2-(2-oxopropoxy)ethoxy]ethyl]heptadecanamide
SMILESCC(=O)COCCOCCNC(=O)CCCCCCCCCCCCCCCC(N)=NN
InChIInChI=1S/C24H48N4O4/c1-22(29)21-32-20-19-31-18-17-27-24(30)16-14-12-10-8-6-4-2-3-5-7-9-11-13-15-23(25)28-26/h2-21,26H2,1H3,(H2,25,28)(H,27,30)
InChIKeyXHEIYOZCEWKAIJ-UHFFFAOYSA-N
MW456.67 g/mol
LogP3.81
Rot. Bonds24

About 17-amino-17-hydrazinylidene-N-[2-[2-(2-oxopropoxy)ethoxy]ethyl]heptadecanamide

17-amino-17-hydrazinylidene-N-[2-[2-(2-oxopropoxy)ethoxy]ethyl]heptadecanamide (PubChem CID 123710561) has the molecular formula C24H48N4O4 and a molecular weight of 456.67 g/mol. Its IUPAC name is 17-amino-17-hydrazinylidene-N-[2-[2-(2-oxopropoxy)ethoxy]ethyl]heptadecanamide.

Molecular Properties

Compound Name17-amino-17-hydrazinylidene-N-[2-[2-(2-oxopropoxy)ethoxy]ethyl]heptadecanamide
PubChem CID123710561
Molecular FormulaC24H48N4O4
Molecular Weight456.67 g/mol
Exact Mass456.37
IUPAC Name17-amino-17-hydrazinylidene-N-[2-[2-(2-oxopropoxy)ethoxy]ethyl]heptadecanamide
SMILESCC(=O)COCCOCCNC(=O)CCCCCCCCCCCCCCCC(N)=NN
InChIInChI=1S/C24H48N4O4/c1-22(29)21-32-20-19-31-18-17-27-24(30)16-14-12-10-8-6-4-2-3-5-7-9-11-13-15-23(25)28-26/h2-21,26H2,1H3,(H2,25,28)(H,27,30)
InChIKeyXHEIYOZCEWKAIJ-UHFFFAOYSA-N
XLogP3.81
TPSA129.03 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds24
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500456.67
LogP ≤ 53.81
H-Bond Donors ≤ 53
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': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

16-amino-N-[2-[2-(2-oxopropoxy)ethoxy]ethyl]hexadecanamide;ethane
CID 145370854
9-hydroxy-N-[2-[2-[2-[2-(2-oxopropoxy)ethoxy]ethoxy]ethoxy]ethyl]nonanamide;vanadium
CID 155741032
9-methoxy-N-[2-[2-[2-[2-[2-[2-(2-oxopropoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]nonanamide
CID 155405230
18-oxo-18-[[4-oxo-4-[[4-oxo-4-[[4-oxo-4-[2-[2-[2-oxo-2-[2-[2-(2-oxopropoxy)ethoxy]ethylamino]ethoxy]ethoxy]ethylamino]butyl]amino]butyl]amino]butyl]amino]octadecanoic acid
CID 139387525
5-oxo-5-[2-[2-[2-oxo-2-[2-[2-(2-oxopropoxy)ethoxy]ethylamino]ethoxy]ethoxy]ethylamino]pentanoic acid
CID 130440881
(17Z)-17-hydrazinyl-17-hydrazinylidene-N-[4-oxo-4-[[4-oxo-4-[[4-oxo-4-[[4-oxo-4-[2-[2-(2-oxopropoxy)ethoxy]ethylamino]butyl]amino]butyl]amino]butyl]amino]butyl]sulfinylheptadecanamide
CID 134334127
6-oxo-N-[2-[2-[2-oxo-5-[2-(2-oxopropoxy)ethoxy]pentoxy]ethoxy]ethyl]octanamide
CID 58143549
3-ethylsulfonyl-N-[2-[2-(2-oxopropoxy)ethoxy]ethyl]propanamide
CID 163564871
2-[2-(2-oxopropoxy)ethoxy]-N-[2-(2-oxopropoxy)ethyl]acetamide
CID 169276802
6-amino-N-[2-(2-amino-2-oxoethoxy)ethyl]hexanamide
CID 106236522
14-[2-[2-[2-[[(1S)-1-carboxy-4-oxo-4-[2-[2-(2-oxopropoxy)ethoxy]ethylamino]butyl]amino]-2-oxoethoxy]ethoxy]ethylamino]-14-oxotetradecanoic acid
CID 149148398
ethane;5-(2-formamidoethoxy)-N-[2-[2-(2-oxopropoxy)ethoxy]ethyl]pentanamide;pentane
CID 156865396

Frequently Asked Questions

What is the IUPAC name of 17-amino-17-hydrazinylidene-N-[2-[2-(2-oxopropoxy)ethoxy]ethyl]heptadecanamide?
The IUPAC name of 17-amino-17-hydrazinylidene-N-[2-[2-(2-oxopropoxy)ethoxy]ethyl]heptadecanamide (CID 123710561) is 17-amino-17-hydrazinylidene-N-[2-[2-(2-oxopropoxy)ethoxy]ethyl]heptadecanamide.
What is the SMILES notation for 17-amino-17-hydrazinylidene-N-[2-[2-(2-oxopropoxy)ethoxy]ethyl]heptadecanamide?
The canonical SMILES for 17-amino-17-hydrazinylidene-N-[2-[2-(2-oxopropoxy)ethoxy]ethyl]heptadecanamide is CC(=O)COCCOCCNC(=O)CCCCCCCCCCCCCCCC(N)=NN.
What is the InChIKey of 17-amino-17-hydrazinylidene-N-[2-[2-(2-oxopropoxy)ethoxy]ethyl]heptadecanamide?
The InChIKey is XHEIYOZCEWKAIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H48N4O4/c1-22(29)21-32-20-19-31-18-17-27-24(30)16-14-12-10-8-6-4-2-3-5-7-9-11-13-15-23(25)28-26/h2-21,26H2,1H3,(H2,25,28)(H,27,30).
What are the key properties of 17-amino-17-hydrazinylidene-N-[2-[2-(2-oxopropoxy)ethoxy]ethyl]heptadecanamide?
17-amino-17-hydrazinylidene-N-[2-[2-(2-oxopropoxy)ethoxy]ethyl]heptadecanamide has a molecular weight of 456.67 g/mol, XLogP of 3.81, 24 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 17-amino-17-hydrazinylidene-N-[2-[2-(2-oxopropoxy)ethoxy]ethyl]heptadecanamide is sourced from PubChem (CID 123710561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).