2-ethoxy-N-ethyl-N-[(2-hydrazinyl-4-pyridinyl)methyl]ethanamine

C12H22N4O — CID 63690883

IUPAC2-ethoxy-N-ethyl-N-[(2-hydrazinyl-4-pyridinyl)methyl]ethanamine
SMILESCCOCCN(CC)Cc1ccnc(NN)c1
InChIInChI=1S/C12H22N4O/c1-3-16(7-8-17-4-2)10-11-5-6-14-12(9-11)15-13/h5-6,9H,3-4,7-8,10,13H2,1-2H3,(H,14,15)
InChIKeyQYBIMDYGWDFKIK-UHFFFAOYSA-N
MW238.33 g/mol
LogP1.23
Rot. Bonds8

About 2-ethoxy-N-ethyl-N-[(2-hydrazinyl-4-pyridinyl)methyl]ethanamine

2-ethoxy-N-ethyl-N-[(2-hydrazinyl-4-pyridinyl)methyl]ethanamine (PubChem CID 63690883) has the molecular formula C12H22N4O and a molecular weight of 238.33 g/mol. Its IUPAC name is 2-ethoxy-N-ethyl-N-[(2-hydrazinyl-4-pyridinyl)methyl]ethanamine.

Molecular Properties

Compound Name2-ethoxy-N-ethyl-N-[(2-hydrazinyl-4-pyridinyl)methyl]ethanamine
PubChem CID63690883
Molecular FormulaC12H22N4O
Molecular Weight238.33 g/mol
Exact Mass238.18
IUPAC Name2-ethoxy-N-ethyl-N-[(2-hydrazinyl-4-pyridinyl)methyl]ethanamine
SMILESCCOCCN(CC)Cc1ccnc(NN)c1
InChIInChI=1S/C12H22N4O/c1-3-16(7-8-17-4-2)10-11-5-6-14-12(9-11)15-13/h5-6,9H,3-4,7-8,10,13H2,1-2H3,(H,14,15)
InChIKeyQYBIMDYGWDFKIK-UHFFFAOYSA-N
XLogP1.23
TPSA63.41 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 51.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-ethyl-N-[(2-hydrazinyl-4-pyridinyl)methyl]ethanamine?
The IUPAC name of 2-ethoxy-N-ethyl-N-[(2-hydrazinyl-4-pyridinyl)methyl]ethanamine (CID 63690883) is 2-ethoxy-N-ethyl-N-[(2-hydrazinyl-4-pyridinyl)methyl]ethanamine.
What is the SMILES notation for 2-ethoxy-N-ethyl-N-[(2-hydrazinyl-4-pyridinyl)methyl]ethanamine?
The canonical SMILES for 2-ethoxy-N-ethyl-N-[(2-hydrazinyl-4-pyridinyl)methyl]ethanamine is CCOCCN(CC)Cc1ccnc(NN)c1.
What is the InChIKey of 2-ethoxy-N-ethyl-N-[(2-hydrazinyl-4-pyridinyl)methyl]ethanamine?
The InChIKey is QYBIMDYGWDFKIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4O/c1-3-16(7-8-17-4-2)10-11-5-6-14-12(9-11)15-13/h5-6,9H,3-4,7-8,10,13H2,1-2H3,(H,14,15).
What are the key properties of 2-ethoxy-N-ethyl-N-[(2-hydrazinyl-4-pyridinyl)methyl]ethanamine?
2-ethoxy-N-ethyl-N-[(2-hydrazinyl-4-pyridinyl)methyl]ethanamine has a molecular weight of 238.33 g/mol, XLogP of 1.23, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-ethyl-N-[(2-hydrazinyl-4-pyridinyl)methyl]ethanamine is sourced from PubChem (CID 63690883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).