N,N-dimethylethanamine;ethane;N-ethyl-N-methylethanamine

C13H36N2 — CID 161494620

IUPACN,N-dimethylethanamine;ethane;N-ethyl-N-methylethanamine
SMILESCC.CC.CCN(C)C.CCN(C)CC
InChIInChI=1S/C5H13N.C4H11N.2C2H6/c1-4-6(3)5-2;1-4-5(2)3;2*1-2/h4-5H2,1-3H3;4H2,1-3H3;2*1-2H3
InChIKeyWGAPHSUAFCVMIP-UHFFFAOYSA-N
MW220.44 g/mol
LogP3.58
Rot. Bonds3

About N,N-dimethylethanamine;ethane;N-ethyl-N-methylethanamine

N,N-dimethylethanamine;ethane;N-ethyl-N-methylethanamine (PubChem CID 161494620) has the molecular formula C13H36N2 and a molecular weight of 220.44 g/mol. Its IUPAC name is N,N-dimethylethanamine;ethane;N-ethyl-N-methylethanamine.

Molecular Properties

Compound NameN,N-dimethylethanamine;ethane;N-ethyl-N-methylethanamine
PubChem CID161494620
Molecular FormulaC13H36N2
Molecular Weight220.44 g/mol
Exact Mass220.29
IUPAC NameN,N-dimethylethanamine;ethane;N-ethyl-N-methylethanamine
SMILESCC.CC.CCN(C)C.CCN(C)CC
InChIInChI=1S/C5H13N.C4H11N.2C2H6/c1-4-6(3)5-2;1-4-5(2)3;2*1-2/h4-5H2,1-3H3;4H2,1-3H3;2*1-2H3
InChIKeyWGAPHSUAFCVMIP-UHFFFAOYSA-N
XLogP3.58
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.44
LogP ≤ 53.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

ethane;N-ethyl-N-methylethanamine;propane
CID 170620045
N,N-dimethylethanamine;N,N-dimethylmethanamine;ethane
CID 142201174
N,N-dimethylethanamine;ethane;methanamine
CID 145153553
N,N-diethylethanamine;N,N-dimethylethanamine
CID 87629474
N-ethyl-N-methylethanamine;methanamine
CID 145177387
N,N-dimethylethanamine;methane
CID 159924855
azane;N,N-dimethylethanamine
CID 91593223
bis(N,N-dimethylethanamine);methane
CID 160872665
N,N-dimethylethanamine;hydroiodide
CID 173048873
N,N-dimethylpropan-1-amine;N-ethyl-N-methylethanamine
CID 118123590
ethane;N-ethyl-N-methylethanamine;methanamine;N-methylmethanamine;propane
CID 142350107
N,N-dimethylethanamine;2-methylpropane
CID 145274023

Frequently Asked Questions

What is the IUPAC name of N,N-dimethylethanamine;ethane;N-ethyl-N-methylethanamine?
The IUPAC name of N,N-dimethylethanamine;ethane;N-ethyl-N-methylethanamine (CID 161494620) is N,N-dimethylethanamine;ethane;N-ethyl-N-methylethanamine.
What is the SMILES notation for N,N-dimethylethanamine;ethane;N-ethyl-N-methylethanamine?
The canonical SMILES for N,N-dimethylethanamine;ethane;N-ethyl-N-methylethanamine is CC.CC.CCN(C)C.CCN(C)CC.
What is the InChIKey of N,N-dimethylethanamine;ethane;N-ethyl-N-methylethanamine?
The InChIKey is WGAPHSUAFCVMIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13N.C4H11N.2C2H6/c1-4-6(3)5-2;1-4-5(2)3;2*1-2/h4-5H2,1-3H3;4H2,1-3H3;2*1-2H3.
What are the key properties of N,N-dimethylethanamine;ethane;N-ethyl-N-methylethanamine?
N,N-dimethylethanamine;ethane;N-ethyl-N-methylethanamine has a molecular weight of 220.44 g/mol, XLogP of 3.58, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethylethanamine;ethane;N-ethyl-N-methylethanamine is sourced from PubChem (CID 161494620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).