N,N-diethylethanamine;hydron;bromide;hydrobromide

C6H17Br2N — CID 173064207

IUPACN,N-diethylethanamine;hydron;bromide;hydrobromide
SMILESBr.CCN(CC)CC.[Br-].[H+]
InChIInChI=1S/C6H15N.2BrH/c1-4-7(5-2)6-3;;/h4-6H2,1-3H3;2*1H
InChIKeyJMUOCDDDFRLJRM-UHFFFAOYSA-N
MW263.02 g/mol
LogP-0.96
Rot. Bonds3

About N,N-diethylethanamine;hydron;bromide;hydrobromide

N,N-diethylethanamine;hydron;bromide;hydrobromide (PubChem CID 173064207) has the molecular formula C6H17Br2N and a molecular weight of 263.02 g/mol. Its IUPAC name is N,N-diethylethanamine;hydron;bromide;hydrobromide.

Molecular Properties

Compound NameN,N-diethylethanamine;hydron;bromide;hydrobromide
PubChem CID173064207
Molecular FormulaC6H17Br2N
Molecular Weight263.02 g/mol
Exact Mass260.97
IUPAC NameN,N-diethylethanamine;hydron;bromide;hydrobromide
SMILESBr.CCN(CC)CC.[Br-].[H+]
InChIInChI=1S/C6H15N.2BrH/c1-4-7(5-2)6-3;;/h4-6H2,1-3H3;2*1H
InChIKeyJMUOCDDDFRLJRM-UHFFFAOYSA-N
XLogP-0.96
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.02
LogP ≤ 5-0.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N,N-diethylethanamine;hydron;bromide;hydrobromide?
The IUPAC name of N,N-diethylethanamine;hydron;bromide;hydrobromide (CID 173064207) is N,N-diethylethanamine;hydron;bromide;hydrobromide.
What is the SMILES notation for N,N-diethylethanamine;hydron;bromide;hydrobromide?
The canonical SMILES for N,N-diethylethanamine;hydron;bromide;hydrobromide is Br.CCN(CC)CC.[Br-].[H+].
What is the InChIKey of N,N-diethylethanamine;hydron;bromide;hydrobromide?
The InChIKey is JMUOCDDDFRLJRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15N.2BrH/c1-4-7(5-2)6-3;;/h4-6H2,1-3H3;2*1H.
What are the key properties of N,N-diethylethanamine;hydron;bromide;hydrobromide?
N,N-diethylethanamine;hydron;bromide;hydrobromide has a molecular weight of 263.02 g/mol, XLogP of -0.96, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethylethanamine;hydron;bromide;hydrobromide is sourced from PubChem (CID 173064207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).