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

C11H24N2O2 — CID 88678276

IUPACN,N'-bis(2-ethoxyethyl)propanimidamide
SMILESCCOCC/N=C(\CC)NCCOCC
InChIInChI=1S/C11H24N2O2/c1-4-11(12-7-9-14-5-2)13-8-10-15-6-3/h4-10H2,1-3H3,(H,12,13)
InChIKeyRFRWQVHONNBFJR-UHFFFAOYSA-N
MW216.32 g/mol
LogP1.46
Rot. Bonds9

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

N,N'-bis(2-ethoxyethyl)propanimidamide (PubChem CID 88678276) has the molecular formula C11H24N2O2 and a molecular weight of 216.32 g/mol. Its IUPAC name is N,N'-bis(2-ethoxyethyl)propanimidamide.

Molecular Properties

Compound NameN,N'-bis(2-ethoxyethyl)propanimidamide
PubChem CID88678276
Molecular FormulaC11H24N2O2
Molecular Weight216.32 g/mol
Exact Mass216.18
IUPAC NameN,N'-bis(2-ethoxyethyl)propanimidamide
SMILESCCOCC/N=C(\CC)NCCOCC
InChIInChI=1S/C11H24N2O2/c1-4-11(12-7-9-14-5-2)13-8-10-15-6-3/h4-10H2,1-3H3,(H,12,13)
InChIKeyRFRWQVHONNBFJR-UHFFFAOYSA-N
XLogP1.46
TPSA42.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.32
LogP ≤ 51.46
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)propanimidamide?
The IUPAC name of N,N'-bis(2-ethoxyethyl)propanimidamide (CID 88678276) is N,N'-bis(2-ethoxyethyl)propanimidamide.
What is the SMILES notation for N,N'-bis(2-ethoxyethyl)propanimidamide?
The canonical SMILES for N,N'-bis(2-ethoxyethyl)propanimidamide is CCOCC/N=C(\CC)NCCOCC.
What is the InChIKey of N,N'-bis(2-ethoxyethyl)propanimidamide?
The InChIKey is RFRWQVHONNBFJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2/c1-4-11(12-7-9-14-5-2)13-8-10-15-6-3/h4-10H2,1-3H3,(H,12,13).
What are the key properties of N,N'-bis(2-ethoxyethyl)propanimidamide?
N,N'-bis(2-ethoxyethyl)propanimidamide has a molecular weight of 216.32 g/mol, XLogP of 1.46, 9 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)propanimidamide is sourced from PubChem (CID 88678276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).