N-[2-[2-[2-[bis(ethenyl)amino]ethoxy]ethoxy]ethyl]-N-ethenylformamide

C13H22N2O3 — CID 58527277

IUPACN-[2-[2-[2-[bis(ethenyl)amino]ethoxy]ethoxy]ethyl]-N-ethenylformamide
SMILESC=CN(C=C)CCOCCOCCN(C=C)C=O
InChIInChI=1S/C13H22N2O3/c1-4-14(5-2)7-9-17-11-12-18-10-8-15(6-3)13-16/h4-6,13H,1-3,7-12H2
InChIKeyUAEJBSCVEXBKET-UHFFFAOYSA-N
MW254.33 g/mol
LogP1.21
Rot. Bonds13

About N-[2-[2-[2-[bis(ethenyl)amino]ethoxy]ethoxy]ethyl]-N-ethenylformamide

N-[2-[2-[2-[bis(ethenyl)amino]ethoxy]ethoxy]ethyl]-N-ethenylformamide (PubChem CID 58527277) has the molecular formula C13H22N2O3 and a molecular weight of 254.33 g/mol. Its IUPAC name is N-[2-[2-[2-[bis(ethenyl)amino]ethoxy]ethoxy]ethyl]-N-ethenylformamide.

Molecular Properties

Compound NameN-[2-[2-[2-[bis(ethenyl)amino]ethoxy]ethoxy]ethyl]-N-ethenylformamide
PubChem CID58527277
Molecular FormulaC13H22N2O3
Molecular Weight254.33 g/mol
Exact Mass254.16
IUPAC NameN-[2-[2-[2-[bis(ethenyl)amino]ethoxy]ethoxy]ethyl]-N-ethenylformamide
SMILESC=CN(C=C)CCOCCOCCN(C=C)C=O
InChIInChI=1S/C13H22N2O3/c1-4-14(5-2)7-9-17-11-12-18-10-8-15(6-3)13-16/h4-6,13H,1-3,7-12H2
InChIKeyUAEJBSCVEXBKET-UHFFFAOYSA-N
XLogP1.21
TPSA42.01 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds13
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 51.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[2-[2-[2-[bis(ethenyl)amino]ethoxy]ethoxy]ethyl]-N-ethenylformamide?
The IUPAC name of N-[2-[2-[2-[bis(ethenyl)amino]ethoxy]ethoxy]ethyl]-N-ethenylformamide (CID 58527277) is N-[2-[2-[2-[bis(ethenyl)amino]ethoxy]ethoxy]ethyl]-N-ethenylformamide.
What is the SMILES notation for N-[2-[2-[2-[bis(ethenyl)amino]ethoxy]ethoxy]ethyl]-N-ethenylformamide?
The canonical SMILES for N-[2-[2-[2-[bis(ethenyl)amino]ethoxy]ethoxy]ethyl]-N-ethenylformamide is C=CN(C=C)CCOCCOCCN(C=C)C=O.
What is the InChIKey of N-[2-[2-[2-[bis(ethenyl)amino]ethoxy]ethoxy]ethyl]-N-ethenylformamide?
The InChIKey is UAEJBSCVEXBKET-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O3/c1-4-14(5-2)7-9-17-11-12-18-10-8-15(6-3)13-16/h4-6,13H,1-3,7-12H2.
What are the key properties of N-[2-[2-[2-[bis(ethenyl)amino]ethoxy]ethoxy]ethyl]-N-ethenylformamide?
N-[2-[2-[2-[bis(ethenyl)amino]ethoxy]ethoxy]ethyl]-N-ethenylformamide has a molecular weight of 254.33 g/mol, XLogP of 1.21, 13 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-[2-[bis(ethenyl)amino]ethoxy]ethoxy]ethyl]-N-ethenylformamide is sourced from PubChem (CID 58527277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).