N-[2-(2-methoxyethoxy)ethyl]-4-methyl-1-propylimidazol-2-amine

C12H23N3O2 — CID 106564440

IUPACN-[2-(2-methoxyethoxy)ethyl]-4-methyl-1-propylimidazol-2-amine
SMILESCCCn1cc(C)nc1NCCOCCOC
InChIInChI=1S/C12H23N3O2/c1-4-6-15-10-11(2)14-12(15)13-5-7-17-9-8-16-3/h10H,4-9H2,1-3H3,(H,13,14)
InChIKeyXRCFQXXMZLJWSW-UHFFFAOYSA-N
MW241.33 g/mol
LogP1.68
Rot. Bonds9

About N-[2-(2-methoxyethoxy)ethyl]-4-methyl-1-propylimidazol-2-amine

N-[2-(2-methoxyethoxy)ethyl]-4-methyl-1-propylimidazol-2-amine (PubChem CID 106564440) has the molecular formula C12H23N3O2 and a molecular weight of 241.33 g/mol. Its IUPAC name is N-[2-(2-methoxyethoxy)ethyl]-4-methyl-1-propylimidazol-2-amine.

Molecular Properties

Compound NameN-[2-(2-methoxyethoxy)ethyl]-4-methyl-1-propylimidazol-2-amine
PubChem CID106564440
Molecular FormulaC12H23N3O2
Molecular Weight241.33 g/mol
Exact Mass241.18
IUPAC NameN-[2-(2-methoxyethoxy)ethyl]-4-methyl-1-propylimidazol-2-amine
SMILESCCCn1cc(C)nc1NCCOCCOC
InChIInChI=1S/C12H23N3O2/c1-4-6-15-10-11(2)14-12(15)13-5-7-17-9-8-16-3/h10H,4-9H2,1-3H3,(H,13,14)
InChIKeyXRCFQXXMZLJWSW-UHFFFAOYSA-N
XLogP1.68
TPSA48.31 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

1-[2-(2-methoxyethoxy)ethyl]-N-(3-methoxypropyl)-4-methylimidazol-2-amine
CID 106564456
1-(2-methoxyethyl)-4-methyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]imidazol-2-amine
CID 106573359
1-(2-methoxyethyl)-4-methyl-N-octylimidazol-2-amine
CID 106578866
1-[2-(2-methoxyethoxy)ethyl]-4-methyl-N-(2-methylpropyl)imidazol-2-amine
CID 106564443
1-butyl-4-methyl-N-[2-(2-methylpropoxy)ethyl]imidazol-2-amine
CID 106582355
1-(2-cyclopropylethyl)-N-(2-methoxyethyl)-4-methylimidazol-2-amine
CID 106575804
1-[4-(2-methoxyethoxy)butyl]-4-methyl-N-prop-2-enylimidazol-2-amine
CID 106581178
N-(2-methoxyethyl)-4-methyl-1-(3-pyrrolidin-1-ylpropyl)imidazol-2-amine
CID 106572059
N-(2-cyclopentyloxyethyl)-1-(2-methoxyethyl)-4-methylimidazol-2-amine
CID 106573155
4-methyl-N-(2-methylsulfinylethyl)-1-propylimidazol-2-amine
CID 106581398
N-[1-(3-methoxypropyl)-4-methylimidazol-2-yl]-N',N'-dimethylethane-1,2-diamine
CID 106555104
N',N'-diethyl-N-[1-(3-methoxypropyl)-4-methylimidazol-2-yl]propane-1,3-diamine
CID 106558822

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-methoxyethoxy)ethyl]-4-methyl-1-propylimidazol-2-amine?
The IUPAC name of N-[2-(2-methoxyethoxy)ethyl]-4-methyl-1-propylimidazol-2-amine (CID 106564440) is N-[2-(2-methoxyethoxy)ethyl]-4-methyl-1-propylimidazol-2-amine.
What is the SMILES notation for N-[2-(2-methoxyethoxy)ethyl]-4-methyl-1-propylimidazol-2-amine?
The canonical SMILES for N-[2-(2-methoxyethoxy)ethyl]-4-methyl-1-propylimidazol-2-amine is CCCn1cc(C)nc1NCCOCCOC.
What is the InChIKey of N-[2-(2-methoxyethoxy)ethyl]-4-methyl-1-propylimidazol-2-amine?
The InChIKey is XRCFQXXMZLJWSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O2/c1-4-6-15-10-11(2)14-12(15)13-5-7-17-9-8-16-3/h10H,4-9H2,1-3H3,(H,13,14).
What are the key properties of N-[2-(2-methoxyethoxy)ethyl]-4-methyl-1-propylimidazol-2-amine?
N-[2-(2-methoxyethoxy)ethyl]-4-methyl-1-propylimidazol-2-amine has a molecular weight of 241.33 g/mol, XLogP of 1.68, 9 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-methoxyethoxy)ethyl]-4-methyl-1-propylimidazol-2-amine is sourced from PubChem (CID 106564440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).