N,N-diethylethanamine;N,N-dimethylmethanamine;hydrobromide

C9H25BrN2 — CID 174858391

IUPACN,N-diethylethanamine;N,N-dimethylmethanamine;hydrobromide
SMILESBr.CCN(CC)CC.CN(C)C
InChIInChI=1S/C6H15N.C3H9N.BrH/c1-4-7(5-2)6-3;1-4(2)3;/h4-6H2,1-3H3;1-3H3;1H
InChIKeyJKYYJOATTSCZHP-UHFFFAOYSA-N
MW241.22 g/mol
LogP2.10
Rot. Bonds3

About N,N-diethylethanamine;N,N-dimethylmethanamine;hydrobromide

N,N-diethylethanamine;N,N-dimethylmethanamine;hydrobromide (PubChem CID 174858391) has the molecular formula C9H25BrN2 and a molecular weight of 241.22 g/mol. Its IUPAC name is N,N-diethylethanamine;N,N-dimethylmethanamine;hydrobromide.

Molecular Properties

Compound NameN,N-diethylethanamine;N,N-dimethylmethanamine;hydrobromide
PubChem CID174858391
Molecular FormulaC9H25BrN2
Molecular Weight241.22 g/mol
Exact Mass240.12
IUPAC NameN,N-diethylethanamine;N,N-dimethylmethanamine;hydrobromide
SMILESBr.CCN(CC)CC.CN(C)C
InChIInChI=1S/C6H15N.C3H9N.BrH/c1-4-7(5-2)6-3;1-4(2)3;/h4-6H2,1-3H3;1-3H3;1H
InChIKeyJKYYJOATTSCZHP-UHFFFAOYSA-N
XLogP2.10
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.22
LogP ≤ 52.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N,N-diethylethanamine;ethane
CID 22114990
N,N-diethylethanamine;N,N-dimethylethanamine
CID 87629474
N,N-diethylethanamine;hydron;bromide;hydrobromide
CID 173064207
N,N-diethylethanamine;palladium(2+)
CID 22219787
CID 175820473
CID 175820473
N,N-diethylethanamine chloride
CID 22292735
bis(N,N-diethylethanamine);dihydrate
CID 173331052
N,N-diethylethanamine;1,1-dimethylhydrazine
CID 87141357
alumane;N,N-diethylethanamine;hydrochloride
CID 173388642
N,N-diethylethanamine;neodymium(3+);trichloride
CID 173208753
zinc;N,N-diethylethanamine;chloride
CID 19867119
N,N-dimethylethanamine;N,N-dimethylmethanamine;ethane
CID 142201174

Frequently Asked Questions

What is the IUPAC name of N,N-diethylethanamine;N,N-dimethylmethanamine;hydrobromide?
The IUPAC name of N,N-diethylethanamine;N,N-dimethylmethanamine;hydrobromide (CID 174858391) is N,N-diethylethanamine;N,N-dimethylmethanamine;hydrobromide.
What is the SMILES notation for N,N-diethylethanamine;N,N-dimethylmethanamine;hydrobromide?
The canonical SMILES for N,N-diethylethanamine;N,N-dimethylmethanamine;hydrobromide is Br.CCN(CC)CC.CN(C)C.
What is the InChIKey of N,N-diethylethanamine;N,N-dimethylmethanamine;hydrobromide?
The InChIKey is JKYYJOATTSCZHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15N.C3H9N.BrH/c1-4-7(5-2)6-3;1-4(2)3;/h4-6H2,1-3H3;1-3H3;1H.
What are the key properties of N,N-diethylethanamine;N,N-dimethylmethanamine;hydrobromide?
N,N-diethylethanamine;N,N-dimethylmethanamine;hydrobromide has a molecular weight of 241.22 g/mol, XLogP of 2.10, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethylethanamine;N,N-dimethylmethanamine;hydrobromide is sourced from PubChem (CID 174858391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).