N,N'-bis(2-ethoxyethyl)hexanimidamide

C14H30N2O2 — CID 88678254

IUPACN,N'-bis(2-ethoxyethyl)hexanimidamide
SMILESCCCCC/C(=N\CCOCC)NCCOCC
InChIInChI=1S/C14H30N2O2/c1-4-7-8-9-14(15-10-12-17-5-2)16-11-13-18-6-3/h4-13H2,1-3H3,(H,15,16)
InChIKeyUQVUACAABFMHSO-UHFFFAOYSA-N
MW258.41 g/mol
LogP2.63
Rot. Bonds12

About N,N'-bis(2-ethoxyethyl)hexanimidamide

N,N'-bis(2-ethoxyethyl)hexanimidamide (PubChem CID 88678254) has the molecular formula C14H30N2O2 and a molecular weight of 258.41 g/mol. Its IUPAC name is N,N'-bis(2-ethoxyethyl)hexanimidamide.

Molecular Properties

Compound NameN,N'-bis(2-ethoxyethyl)hexanimidamide
PubChem CID88678254
Molecular FormulaC14H30N2O2
Molecular Weight258.41 g/mol
Exact Mass258.23
IUPAC NameN,N'-bis(2-ethoxyethyl)hexanimidamide
SMILESCCCCC/C(=N\CCOCC)NCCOCC
InChIInChI=1S/C14H30N2O2/c1-4-7-8-9-14(15-10-12-17-5-2)16-11-13-18-6-3/h4-13H2,1-3H3,(H,15,16)
InChIKeyUQVUACAABFMHSO-UHFFFAOYSA-N
XLogP2.63
TPSA42.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds12
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.41
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

N,N'-bis(2-ethoxyethyl)decanimidamide
CID 88679605
N,N'-dipentylpentanimidamide
CID 88678498
1-(2-ethoxyethyl)-2-(3-ethoxypropyl)-3-ethylguanidine
CID 111224057
1-(2-ethoxyethyl)-2-hexylguanidine;hydroiodide
CID 111045515
2-(4-ethoxybutyl)-1-(2-ethoxyethyl)-3-ethylguanidine
CID 111896119
2-(3-ethoxypropyl)-1-ethyl-3-hexylguanidine;hydroiodide
CID 111161864
methyl 5-[[(2-ethoxyethylamino)-(ethylamino)methylidene]amino]pentanoate;hydroiodide
CID 111895746
1-(2-ethoxyethyl)-3-hexyl-2-methylguanidine
CID 111161505
2-(2-ethoxyethyl)-1-ethyl-3-[2-(2-methylpropoxy)ethyl]guanidine;hydroiodide
CID 111895626
1-(3-ethoxypropyl)-3-ethyl-2-propylguanidine
CID 111224259
1-butyl-3-(2-ethoxyethyl)urea
CID 115583017
N-[2-(2-azidoethoxy)ethyl]hexadecanamide
CID 141376233

Frequently Asked Questions

What is the IUPAC name of N,N'-bis(2-ethoxyethyl)hexanimidamide?
The IUPAC name of N,N'-bis(2-ethoxyethyl)hexanimidamide (CID 88678254) is N,N'-bis(2-ethoxyethyl)hexanimidamide.
What is the SMILES notation for N,N'-bis(2-ethoxyethyl)hexanimidamide?
The canonical SMILES for N,N'-bis(2-ethoxyethyl)hexanimidamide is CCCCC/C(=N\CCOCC)NCCOCC.
What is the InChIKey of N,N'-bis(2-ethoxyethyl)hexanimidamide?
The InChIKey is UQVUACAABFMHSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O2/c1-4-7-8-9-14(15-10-12-17-5-2)16-11-13-18-6-3/h4-13H2,1-3H3,(H,15,16).
What are the key properties of N,N'-bis(2-ethoxyethyl)hexanimidamide?
N,N'-bis(2-ethoxyethyl)hexanimidamide has a molecular weight of 258.41 g/mol, XLogP of 2.63, 12 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-bis(2-ethoxyethyl)hexanimidamide is sourced from PubChem (CID 88678254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).