N,N'-dimethyl-N'-[4-methyl-1-(2-methylpropyl)imidazol-2-yl]ethane-1,2-diamine

C12H24N4 — CID 106552757

IUPACN,N'-dimethyl-N'-[4-methyl-1-(2-methylpropyl)imidazol-2-yl]ethane-1,2-diamine
SMILESCNCCN(C)c1nc(C)cn1CC(C)C
InChIInChI=1S/C12H24N4/c1-10(2)8-16-9-11(3)14-12(16)15(5)7-6-13-4/h9-10,13H,6-8H2,1-5H3
InChIKeySWEQNDAZDOJOJE-UHFFFAOYSA-N
MW224.35 g/mol
LogP1.50
Rot. Bonds6

About N,N'-dimethyl-N'-[4-methyl-1-(2-methylpropyl)imidazol-2-yl]ethane-1,2-diamine

N,N'-dimethyl-N'-[4-methyl-1-(2-methylpropyl)imidazol-2-yl]ethane-1,2-diamine (PubChem CID 106552757) has the molecular formula C12H24N4 and a molecular weight of 224.35 g/mol. Its IUPAC name is N,N'-dimethyl-N'-[4-methyl-1-(2-methylpropyl)imidazol-2-yl]ethane-1,2-diamine.

Molecular Properties

Compound NameN,N'-dimethyl-N'-[4-methyl-1-(2-methylpropyl)imidazol-2-yl]ethane-1,2-diamine
PubChem CID106552757
Molecular FormulaC12H24N4
Molecular Weight224.35 g/mol
Exact Mass224.20
IUPAC NameN,N'-dimethyl-N'-[4-methyl-1-(2-methylpropyl)imidazol-2-yl]ethane-1,2-diamine
SMILESCNCCN(C)c1nc(C)cn1CC(C)C
InChIInChI=1S/C12H24N4/c1-10(2)8-16-9-11(3)14-12(16)15(5)7-6-13-4/h9-10,13H,6-8H2,1-5H3
InChIKeySWEQNDAZDOJOJE-UHFFFAOYSA-N
XLogP1.50
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N,N'-dimethyl-N'-[1-(2-methylpropyl)imidazol-2-yl]propane-1,3-diamine
CID 106553235
N'-[1-(3-ethoxypropyl)-4-methylimidazol-2-yl]-N,N'-dimethylpropane-1,3-diamine
CID 106553237
N',N'-dimethyl-N-[4-methyl-1-(2-methylpropyl)imidazol-2-yl]propane-1,3-diamine
CID 106559563
N'-(1-ethyl-4-methylimidazol-2-yl)-N'-methylethane-1,2-diamine
CID 106552472
N'-(1-butyl-4-ethylimidazol-2-yl)-N,N'-dimethylethane-1,2-diamine
CID 106552783
N-(5-bromo-2-methylphenyl)-4-methyl-1-(2-methylpropyl)imidazol-2-amine
CID 106562857
1-ethyl-N,N,4-trimethylimidazol-2-amine
CID 117189633
4-methyl-1-(2-methylpropyl)-N-(3,4,5-trifluorophenyl)imidazol-2-amine
CID 106570791
N-(2,5-dichloro-4-methylphenyl)-4-methyl-1-(2-methylpropyl)imidazol-2-amine
CID 106580603
N-(4-bromo-2,6-difluorophenyl)-4-methyl-1-(2-methylpropyl)imidazol-2-amine
CID 106574063
N-(4-fluorophenyl)-4-methyl-1-(2-methylpropyl)imidazol-2-amine
CID 106558695
N-cyclopropyl-4-methyl-1-(2-methylpropyl)imidazol-2-amine
CID 106554938

Frequently Asked Questions

What is the IUPAC name of N,N'-dimethyl-N'-[4-methyl-1-(2-methylpropyl)imidazol-2-yl]ethane-1,2-diamine?
The IUPAC name of N,N'-dimethyl-N'-[4-methyl-1-(2-methylpropyl)imidazol-2-yl]ethane-1,2-diamine (CID 106552757) is N,N'-dimethyl-N'-[4-methyl-1-(2-methylpropyl)imidazol-2-yl]ethane-1,2-diamine.
What is the SMILES notation for N,N'-dimethyl-N'-[4-methyl-1-(2-methylpropyl)imidazol-2-yl]ethane-1,2-diamine?
The canonical SMILES for N,N'-dimethyl-N'-[4-methyl-1-(2-methylpropyl)imidazol-2-yl]ethane-1,2-diamine is CNCCN(C)c1nc(C)cn1CC(C)C.
What is the InChIKey of N,N'-dimethyl-N'-[4-methyl-1-(2-methylpropyl)imidazol-2-yl]ethane-1,2-diamine?
The InChIKey is SWEQNDAZDOJOJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N4/c1-10(2)8-16-9-11(3)14-12(16)15(5)7-6-13-4/h9-10,13H,6-8H2,1-5H3.
What are the key properties of N,N'-dimethyl-N'-[4-methyl-1-(2-methylpropyl)imidazol-2-yl]ethane-1,2-diamine?
N,N'-dimethyl-N'-[4-methyl-1-(2-methylpropyl)imidazol-2-yl]ethane-1,2-diamine has a molecular weight of 224.35 g/mol, XLogP of 1.50, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-dimethyl-N'-[4-methyl-1-(2-methylpropyl)imidazol-2-yl]ethane-1,2-diamine is sourced from PubChem (CID 106552757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).