N-(2-ethoxyethyl)-4-methyl-1-(2-methylpropyl)imidazol-2-amine

C12H23N3O — CID 106554059

IUPACN-(2-ethoxyethyl)-4-methyl-1-(2-methylpropyl)imidazol-2-amine
SMILESCCOCCNc1nc(C)cn1CC(C)C
InChIInChI=1S/C12H23N3O/c1-5-16-7-6-13-12-14-11(4)9-15(12)8-10(2)3/h9-10H,5-8H2,1-4H3,(H,13,14)
InChIKeyWZERFYNSAHNFPV-UHFFFAOYSA-N
MW225.34 g/mol
LogP2.30
Rot. Bonds7

About N-(2-ethoxyethyl)-4-methyl-1-(2-methylpropyl)imidazol-2-amine

N-(2-ethoxyethyl)-4-methyl-1-(2-methylpropyl)imidazol-2-amine (PubChem CID 106554059) has the molecular formula C12H23N3O and a molecular weight of 225.34 g/mol. Its IUPAC name is N-(2-ethoxyethyl)-4-methyl-1-(2-methylpropyl)imidazol-2-amine.

Molecular Properties

Compound NameN-(2-ethoxyethyl)-4-methyl-1-(2-methylpropyl)imidazol-2-amine
PubChem CID106554059
Molecular FormulaC12H23N3O
Molecular Weight225.34 g/mol
Exact Mass225.18
IUPAC NameN-(2-ethoxyethyl)-4-methyl-1-(2-methylpropyl)imidazol-2-amine
SMILESCCOCCNc1nc(C)cn1CC(C)C
InChIInChI=1S/C12H23N3O/c1-5-16-7-6-13-12-14-11(4)9-15(12)8-10(2)3/h9-10H,5-8H2,1-4H3,(H,13,14)
InChIKeyWZERFYNSAHNFPV-UHFFFAOYSA-N
XLogP2.30
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.34
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(3-ethoxypropyl)-4-methyl-1-(2-methylsulfinylpropyl)imidazol-2-amine
CID 106581056
1-butyl-4-methyl-N-[2-(2-methylpropoxy)ethyl]imidazol-2-amine
CID 106582355
N',N'-dimethyl-N-[4-methyl-1-(2-methylpropyl)imidazol-2-yl]propane-1,3-diamine
CID 106559563
1-ethyl-4-methyl-N-(3-methylbutyl)imidazol-2-amine
CID 106557328
4-methyl-1-(2-methylpropyl)-N-(3-phenylpropyl)imidazol-2-amine
CID 106563183
4-methyl-1-(2-methylpropyl)-N-(3-phenylbutyl)imidazol-2-amine
CID 106572129
N-[2-(2-methoxyethoxy)ethyl]-4-methyl-1-propylimidazol-2-amine
CID 106564440
1-(cyclopentylmethyl)-N-(3-ethoxypropyl)-4-methylimidazol-2-amine
CID 106561789
N-(2-ethoxypropyl)-1-(3-ethoxypropyl)-4-methylimidazol-2-amine
CID 106581223
N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-4-methyl-1-(2-methylpropyl)imidazol-2-amine
CID 106581880
4-methyl-1-(2-methylpropyl)-N-(2-pyridin-2-ylethyl)imidazol-2-amine
CID 106554402
4-methyl-1-(3-methylbutyl)-N-propylimidazol-2-amine
CID 106557292

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyethyl)-4-methyl-1-(2-methylpropyl)imidazol-2-amine?
The IUPAC name of N-(2-ethoxyethyl)-4-methyl-1-(2-methylpropyl)imidazol-2-amine (CID 106554059) is N-(2-ethoxyethyl)-4-methyl-1-(2-methylpropyl)imidazol-2-amine.
What is the SMILES notation for N-(2-ethoxyethyl)-4-methyl-1-(2-methylpropyl)imidazol-2-amine?
The canonical SMILES for N-(2-ethoxyethyl)-4-methyl-1-(2-methylpropyl)imidazol-2-amine is CCOCCNc1nc(C)cn1CC(C)C.
What is the InChIKey of N-(2-ethoxyethyl)-4-methyl-1-(2-methylpropyl)imidazol-2-amine?
The InChIKey is WZERFYNSAHNFPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O/c1-5-16-7-6-13-12-14-11(4)9-15(12)8-10(2)3/h9-10H,5-8H2,1-4H3,(H,13,14).
What are the key properties of N-(2-ethoxyethyl)-4-methyl-1-(2-methylpropyl)imidazol-2-amine?
N-(2-ethoxyethyl)-4-methyl-1-(2-methylpropyl)imidazol-2-amine has a molecular weight of 225.34 g/mol, XLogP of 2.30, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyethyl)-4-methyl-1-(2-methylpropyl)imidazol-2-amine is sourced from PubChem (CID 106554059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).