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

C17H36N2O2 — CID 88678149

IUPACN,N'-bis(2-ethoxyethyl)nonanimidamide
SMILESCCCCCCCC/C(=N\CCOCC)NCCOCC
InChIInChI=1S/C17H36N2O2/c1-4-7-8-9-10-11-12-17(18-13-15-20-5-2)19-14-16-21-6-3/h4-16H2,1-3H3,(H,18,19)
InChIKeyYUULTAOEUQDLMO-UHFFFAOYSA-N
MW300.49 g/mol
LogP3.80
Rot. Bonds15

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

N,N'-bis(2-ethoxyethyl)nonanimidamide (PubChem CID 88678149) has the molecular formula C17H36N2O2 and a molecular weight of 300.49 g/mol. Its IUPAC name is N,N'-bis(2-ethoxyethyl)nonanimidamide.

Molecular Properties

Compound NameN,N'-bis(2-ethoxyethyl)nonanimidamide
PubChem CID88678149
Molecular FormulaC17H36N2O2
Molecular Weight300.49 g/mol
Exact Mass300.28
IUPAC NameN,N'-bis(2-ethoxyethyl)nonanimidamide
SMILESCCCCCCCC/C(=N\CCOCC)NCCOCC
InChIInChI=1S/C17H36N2O2/c1-4-7-8-9-10-11-12-17(18-13-15-20-5-2)19-14-16-21-6-3/h4-16H2,1-3H3,(H,18,19)
InChIKeyYUULTAOEUQDLMO-UHFFFAOYSA-N
XLogP3.80
TPSA42.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds15
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.49
LogP ≤ 53.80
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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Frequently Asked Questions

What is the IUPAC name of N,N'-bis(2-ethoxyethyl)nonanimidamide?
The IUPAC name of N,N'-bis(2-ethoxyethyl)nonanimidamide (CID 88678149) is N,N'-bis(2-ethoxyethyl)nonanimidamide.
What is the SMILES notation for N,N'-bis(2-ethoxyethyl)nonanimidamide?
The canonical SMILES for N,N'-bis(2-ethoxyethyl)nonanimidamide is CCCCCCCC/C(=N\CCOCC)NCCOCC.
What is the InChIKey of N,N'-bis(2-ethoxyethyl)nonanimidamide?
The InChIKey is YUULTAOEUQDLMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H36N2O2/c1-4-7-8-9-10-11-12-17(18-13-15-20-5-2)19-14-16-21-6-3/h4-16H2,1-3H3,(H,18,19).
What are the key properties of N,N'-bis(2-ethoxyethyl)nonanimidamide?
N,N'-bis(2-ethoxyethyl)nonanimidamide has a molecular weight of 300.49 g/mol, XLogP of 3.80, 15 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)nonanimidamide is sourced from PubChem (CID 88678149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).