2-[(2-ethenylhydrazinyl)-methylamino]ethanol

C5H13N3O — CID 145470964

IUPAC2-[(2-ethenylhydrazinyl)-methylamino]ethanol
SMILESC=CNNN(C)CCO
InChIInChI=1S/C5H13N3O/c1-3-6-7-8(2)4-5-9/h3,6-7,9H,1,4-5H2,2H3
InChIKeyWTNDVVUBGHHTDU-UHFFFAOYSA-N
MW131.18 g/mol
LogP-0.94
Rot. Bonds5

About 2-[(2-ethenylhydrazinyl)-methylamino]ethanol

2-[(2-ethenylhydrazinyl)-methylamino]ethanol (PubChem CID 145470964) has the molecular formula C5H13N3O and a molecular weight of 131.18 g/mol. Its IUPAC name is 2-[(2-ethenylhydrazinyl)-methylamino]ethanol.

Molecular Properties

Compound Name2-[(2-ethenylhydrazinyl)-methylamino]ethanol
PubChem CID145470964
Molecular FormulaC5H13N3O
Molecular Weight131.18 g/mol
Exact Mass131.11
IUPAC Name2-[(2-ethenylhydrazinyl)-methylamino]ethanol
SMILESC=CNNN(C)CCO
InChIInChI=1S/C5H13N3O/c1-3-6-7-8(2)4-5-9/h3,6-7,9H,1,4-5H2,2H3
InChIKeyWTNDVVUBGHHTDU-UHFFFAOYSA-N
XLogP-0.94
TPSA47.53 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.18
LogP ≤ 5-0.94
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[(2-ethenylhydrazinyl)-methylamino]ethanol?
The IUPAC name of 2-[(2-ethenylhydrazinyl)-methylamino]ethanol (CID 145470964) is 2-[(2-ethenylhydrazinyl)-methylamino]ethanol.
What is the SMILES notation for 2-[(2-ethenylhydrazinyl)-methylamino]ethanol?
The canonical SMILES for 2-[(2-ethenylhydrazinyl)-methylamino]ethanol is C=CNNN(C)CCO.
What is the InChIKey of 2-[(2-ethenylhydrazinyl)-methylamino]ethanol?
The InChIKey is WTNDVVUBGHHTDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13N3O/c1-3-6-7-8(2)4-5-9/h3,6-7,9H,1,4-5H2,2H3.
What are the key properties of 2-[(2-ethenylhydrazinyl)-methylamino]ethanol?
2-[(2-ethenylhydrazinyl)-methylamino]ethanol has a molecular weight of 131.18 g/mol, XLogP of -0.94, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-ethenylhydrazinyl)-methylamino]ethanol is sourced from PubChem (CID 145470964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).