1-(2-bromoethyl)-1-ethyl-2-methylhydrazine

C5H13BrN2 — CID 167224537

IUPAC1-(2-bromoethyl)-1-ethyl-2-methylhydrazine
SMILESCCN(CCBr)NC
InChIInChI=1S/C5H13BrN2/c1-3-8(7-2)5-4-6/h7H,3-5H2,1-2H3
InChIKeyLWFFAUMWHJIFMS-UHFFFAOYSA-N
MW181.08 g/mol
LogP0.84
Rot. Bonds4

About 1-(2-bromoethyl)-1-ethyl-2-methylhydrazine

1-(2-bromoethyl)-1-ethyl-2-methylhydrazine (PubChem CID 167224537) has the molecular formula C5H13BrN2 and a molecular weight of 181.08 g/mol. Its IUPAC name is 1-(2-bromoethyl)-1-ethyl-2-methylhydrazine.

Molecular Properties

Compound Name1-(2-bromoethyl)-1-ethyl-2-methylhydrazine
PubChem CID167224537
Molecular FormulaC5H13BrN2
Molecular Weight181.08 g/mol
Exact Mass180.03
IUPAC Name1-(2-bromoethyl)-1-ethyl-2-methylhydrazine
SMILESCCN(CCBr)NC
InChIInChI=1S/C5H13BrN2/c1-3-8(7-2)5-4-6/h7H,3-5H2,1-2H3
InChIKeyLWFFAUMWHJIFMS-UHFFFAOYSA-N
XLogP0.84
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.08
LogP ≤ 50.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', '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 1-(2-bromoethyl)-1-ethyl-2-methylhydrazine?
The IUPAC name of 1-(2-bromoethyl)-1-ethyl-2-methylhydrazine (CID 167224537) is 1-(2-bromoethyl)-1-ethyl-2-methylhydrazine.
What is the SMILES notation for 1-(2-bromoethyl)-1-ethyl-2-methylhydrazine?
The canonical SMILES for 1-(2-bromoethyl)-1-ethyl-2-methylhydrazine is CCN(CCBr)NC.
What is the InChIKey of 1-(2-bromoethyl)-1-ethyl-2-methylhydrazine?
The InChIKey is LWFFAUMWHJIFMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13BrN2/c1-3-8(7-2)5-4-6/h7H,3-5H2,1-2H3.
What are the key properties of 1-(2-bromoethyl)-1-ethyl-2-methylhydrazine?
1-(2-bromoethyl)-1-ethyl-2-methylhydrazine has a molecular weight of 181.08 g/mol, XLogP of 0.84, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-bromoethyl)-1-ethyl-2-methylhydrazine is sourced from PubChem (CID 167224537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).