1-[2-(2-methoxyethoxy)ethyl]-N-prop-2-enylimidazol-2-amine

C11H19N3O2 — CID 106564442

IUPAC1-[2-(2-methoxyethoxy)ethyl]-N-prop-2-enylimidazol-2-amine
SMILESC=CCNc1nccn1CCOCCOC
InChIInChI=1S/C11H19N3O2/c1-3-4-12-11-13-5-6-14(11)7-8-16-10-9-15-2/h3,5-6H,1,4,7-10H2,2H3,(H,12,13)
InChIKeyDAJQOZWWCJGOLD-UHFFFAOYSA-N
MW225.29 g/mol
LogP1.14
Rot. Bonds9

About 1-[2-(2-methoxyethoxy)ethyl]-N-prop-2-enylimidazol-2-amine

1-[2-(2-methoxyethoxy)ethyl]-N-prop-2-enylimidazol-2-amine (PubChem CID 106564442) has the molecular formula C11H19N3O2 and a molecular weight of 225.29 g/mol. Its IUPAC name is 1-[2-(2-methoxyethoxy)ethyl]-N-prop-2-enylimidazol-2-amine.

Molecular Properties

Compound Name1-[2-(2-methoxyethoxy)ethyl]-N-prop-2-enylimidazol-2-amine
PubChem CID106564442
Molecular FormulaC11H19N3O2
Molecular Weight225.29 g/mol
Exact Mass225.15
IUPAC Name1-[2-(2-methoxyethoxy)ethyl]-N-prop-2-enylimidazol-2-amine
SMILESC=CCNc1nccn1CCOCCOC
InChIInChI=1S/C11H19N3O2/c1-3-4-12-11-13-5-6-14(11)7-8-16-10-9-15-2/h3,5-6H,1,4,7-10H2,2H3,(H,12,13)
InChIKeyDAJQOZWWCJGOLD-UHFFFAOYSA-N
XLogP1.14
TPSA48.31 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-ethyl-1-[2-(2-methoxyethoxy)ethyl]imidazol-2-amine
CID 106564453
N-[4-(2-methoxyethoxy)butyl]-1-(2-methoxyethyl)imidazol-2-amine
CID 106581208
1-[4-(2-methoxyethoxy)butyl]-N-(3-methoxypropyl)imidazol-2-amine
CID 106581197
1-(2-methoxy-2-methylpropyl)-N-prop-2-enylimidazol-2-amine
CID 106581296
1-(3-methylsulfanylpropyl)-N-prop-2-enylimidazol-2-amine
CID 106573669
1-butyl-N-[4-(2-methoxyethoxy)butyl]imidazol-2-amine
CID 106581195
1-[4-(2-methoxyethoxy)butyl]-4-methyl-N-prop-2-enylimidazol-2-amine
CID 106581178
N-ethyl-1-(4-methoxybutyl)imidazol-2-amine
CID 106565023
1-(2,3-dimethylbutyl)-N-prop-2-enylimidazol-2-amine
CID 106575242
N-(3-ethoxypropyl)-1-(2-methoxyethyl)imidazol-2-amine
CID 106554857
1-(2-ethoxy-2-methylpropyl)-N-prop-2-enylimidazol-2-amine
CID 106583268
1-[2-(1-methylpiperidin-4-yl)ethyl]-N-prop-2-enylimidazol-2-amine
CID 106581944

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-methoxyethoxy)ethyl]-N-prop-2-enylimidazol-2-amine?
The IUPAC name of 1-[2-(2-methoxyethoxy)ethyl]-N-prop-2-enylimidazol-2-amine (CID 106564442) is 1-[2-(2-methoxyethoxy)ethyl]-N-prop-2-enylimidazol-2-amine.
What is the SMILES notation for 1-[2-(2-methoxyethoxy)ethyl]-N-prop-2-enylimidazol-2-amine?
The canonical SMILES for 1-[2-(2-methoxyethoxy)ethyl]-N-prop-2-enylimidazol-2-amine is C=CCNc1nccn1CCOCCOC.
What is the InChIKey of 1-[2-(2-methoxyethoxy)ethyl]-N-prop-2-enylimidazol-2-amine?
The InChIKey is DAJQOZWWCJGOLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O2/c1-3-4-12-11-13-5-6-14(11)7-8-16-10-9-15-2/h3,5-6H,1,4,7-10H2,2H3,(H,12,13).
What are the key properties of 1-[2-(2-methoxyethoxy)ethyl]-N-prop-2-enylimidazol-2-amine?
1-[2-(2-methoxyethoxy)ethyl]-N-prop-2-enylimidazol-2-amine has a molecular weight of 225.29 g/mol, XLogP of 1.14, 9 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-methoxyethoxy)ethyl]-N-prop-2-enylimidazol-2-amine is sourced from PubChem (CID 106564442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).