N'-ethyl-N'-[1-(2-methoxyethyl)-4-methylimidazol-2-yl]ethane-1,2-diamine

C11H22N4O — CID 106553976

IUPACN'-ethyl-N'-[1-(2-methoxyethyl)-4-methylimidazol-2-yl]ethane-1,2-diamine
SMILESCCN(CCN)c1nc(C)cn1CCOC
InChIInChI=1S/C11H22N4O/c1-4-14(6-5-12)11-13-10(2)9-15(11)7-8-16-3/h9H,4-8,12H2,1-3H3
InChIKeyPSQMSLVGOQCGIZ-UHFFFAOYSA-N
MW226.32 g/mol
LogP0.62
Rot. Bonds7

About N'-ethyl-N'-[1-(2-methoxyethyl)-4-methylimidazol-2-yl]ethane-1,2-diamine

N'-ethyl-N'-[1-(2-methoxyethyl)-4-methylimidazol-2-yl]ethane-1,2-diamine (PubChem CID 106553976) has the molecular formula C11H22N4O and a molecular weight of 226.32 g/mol. Its IUPAC name is N'-ethyl-N'-[1-(2-methoxyethyl)-4-methylimidazol-2-yl]ethane-1,2-diamine.

Molecular Properties

Compound NameN'-ethyl-N'-[1-(2-methoxyethyl)-4-methylimidazol-2-yl]ethane-1,2-diamine
PubChem CID106553976
Molecular FormulaC11H22N4O
Molecular Weight226.32 g/mol
Exact Mass226.18
IUPAC NameN'-ethyl-N'-[1-(2-methoxyethyl)-4-methylimidazol-2-yl]ethane-1,2-diamine
SMILESCCN(CCN)c1nc(C)cn1CCOC
InChIInChI=1S/C11H22N4O/c1-4-14(6-5-12)11-13-10(2)9-15(11)7-8-16-3/h9H,4-8,12H2,1-3H3
InChIKeyPSQMSLVGOQCGIZ-UHFFFAOYSA-N
XLogP0.62
TPSA56.31 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-ethyl-1-(2-methoxyethyl)-4-methyl-N-(piperidin-4-ylmethyl)imidazol-2-amine
CID 106553080
N'-ethyl-N'-(4-ethyl-1-propylimidazol-2-yl)ethane-1,2-diamine
CID 106553982
N'-(1-ethyl-4-methylimidazol-2-yl)-N'-methylethane-1,2-diamine
CID 106552472
N'-[4-ethyl-1-(2-methoxyethyl)imidazol-2-yl]-N'-methylpropane-1,3-diamine
CID 106553611
N-[1-(2-methoxyethyl)-4-methylimidazol-2-yl]-N-methyl-8-azabicyclo[3.2.1]octan-3-amine
CID 106552110
N'-[1-(1-methoxypropan-2-yl)-4-methylimidazol-2-yl]-N'-methylethane-1,2-diamine
CID 106552497
N-(4-chloro-2-fluorophenyl)-1-(2-methoxyethyl)-4-methylimidazol-2-amine
CID 106568956
3-N-[1-(2-methoxyethyl)-4-methylimidazol-2-yl]-1-N,1-N-dimethylbutane-1,3-diamine
CID 106567740
N'-[4-ethyl-1-(3-methoxypropyl)imidazol-2-yl]-N'-methylpropane-1,3-diamine
CID 106553597
1-(2-methoxyethyl)-4-methyl-N-octylimidazol-2-amine
CID 106578866
N',N'-diethyl-N-[1-(3-methoxypropyl)-4-methylimidazol-2-yl]propane-1,3-diamine
CID 106558822
N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-1-(2-methoxyethyl)-4-methylimidazol-2-amine
CID 106581885

Frequently Asked Questions

What is the IUPAC name of N'-ethyl-N'-[1-(2-methoxyethyl)-4-methylimidazol-2-yl]ethane-1,2-diamine?
The IUPAC name of N'-ethyl-N'-[1-(2-methoxyethyl)-4-methylimidazol-2-yl]ethane-1,2-diamine (CID 106553976) is N'-ethyl-N'-[1-(2-methoxyethyl)-4-methylimidazol-2-yl]ethane-1,2-diamine.
What is the SMILES notation for N'-ethyl-N'-[1-(2-methoxyethyl)-4-methylimidazol-2-yl]ethane-1,2-diamine?
The canonical SMILES for N'-ethyl-N'-[1-(2-methoxyethyl)-4-methylimidazol-2-yl]ethane-1,2-diamine is CCN(CCN)c1nc(C)cn1CCOC.
What is the InChIKey of N'-ethyl-N'-[1-(2-methoxyethyl)-4-methylimidazol-2-yl]ethane-1,2-diamine?
The InChIKey is PSQMSLVGOQCGIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N4O/c1-4-14(6-5-12)11-13-10(2)9-15(11)7-8-16-3/h9H,4-8,12H2,1-3H3.
What are the key properties of N'-ethyl-N'-[1-(2-methoxyethyl)-4-methylimidazol-2-yl]ethane-1,2-diamine?
N'-ethyl-N'-[1-(2-methoxyethyl)-4-methylimidazol-2-yl]ethane-1,2-diamine has a molecular weight of 226.32 g/mol, XLogP of 0.62, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-ethyl-N'-[1-(2-methoxyethyl)-4-methylimidazol-2-yl]ethane-1,2-diamine is sourced from PubChem (CID 106553976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).