[1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]imidazol-2-yl]methanamine

C11H21N3O3 — CID 113427307

IUPAC[1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]imidazol-2-yl]methanamine
SMILESCOCCOCCOCCn1ccnc1CN
InChIInChI=1S/C11H21N3O3/c1-15-6-7-17-9-8-16-5-4-14-3-2-13-11(14)10-12/h2-3H,4-10,12H2,1H3
InChIKeyILGOVTHKGGDGOO-UHFFFAOYSA-N
MW243.31 g/mol
LogP0.02
Rot. Bonds10

About [1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]imidazol-2-yl]methanamine

[1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]imidazol-2-yl]methanamine (PubChem CID 113427307) has the molecular formula C11H21N3O3 and a molecular weight of 243.31 g/mol. Its IUPAC name is [1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]imidazol-2-yl]methanamine.

Molecular Properties

Compound Name[1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]imidazol-2-yl]methanamine
PubChem CID113427307
Molecular FormulaC11H21N3O3
Molecular Weight243.31 g/mol
Exact Mass243.16
IUPAC Name[1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]imidazol-2-yl]methanamine
SMILESCOCCOCCOCCn1ccnc1CN
InChIInChI=1S/C11H21N3O3/c1-15-6-7-17-9-8-16-5-4-14-3-2-13-11(14)10-12/h2-3H,4-10,12H2,1H3
InChIKeyILGOVTHKGGDGOO-UHFFFAOYSA-N
XLogP0.02
TPSA71.53 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds10
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 50.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

[1-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]imidazol-2-yl]methanamine
CID 104565415
1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-2-propylimidazole
CID 113427513
2-[1-(2-methoxyethyl)imidazol-2-yl]ethanamine
CID 62410004
ethane;2-ethyl-1-(2-methoxyethyl)imidazole
CID 164585283
N-ethyl-1-[2-(2-methoxyethoxy)ethyl]imidazol-2-amine
CID 106564453
[1-[2-(1-methylimidazol-2-yl)ethyl]imidazol-2-yl]methanamine
CID 114528906
1-[2-(2-methoxyethoxy)ethyl]-N-prop-2-enylimidazol-2-amine
CID 106564442
N-[4-(2-methoxyethoxy)butyl]-1-(2-methoxyethyl)imidazol-2-amine
CID 106581208
3-(2-methoxyethoxy)-1-(1-propylimidazol-2-yl)propan-1-amine
CID 102927817
N-[[1-(2-propoxyethyl)imidazol-2-yl]methyl]ethanamine
CID 106455233
[2-[3-(2-methoxyethoxy)propyl]-1,2,4-triazol-3-yl]methanamine
CID 103412848
[1-(1-ethylimidazol-2-yl)-3-(2-methoxyethoxy)propyl]hydrazine
CID 102929970

Frequently Asked Questions

What is the IUPAC name of [1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]imidazol-2-yl]methanamine?
The IUPAC name of [1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]imidazol-2-yl]methanamine (CID 113427307) is [1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]imidazol-2-yl]methanamine.
What is the SMILES notation for [1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]imidazol-2-yl]methanamine?
The canonical SMILES for [1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]imidazol-2-yl]methanamine is COCCOCCOCCn1ccnc1CN.
What is the InChIKey of [1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]imidazol-2-yl]methanamine?
The InChIKey is ILGOVTHKGGDGOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O3/c1-15-6-7-17-9-8-16-5-4-14-3-2-13-11(14)10-12/h2-3H,4-10,12H2,1H3.
What are the key properties of [1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]imidazol-2-yl]methanamine?
[1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]imidazol-2-yl]methanamine has a molecular weight of 243.31 g/mol, XLogP of 0.02, 10 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]imidazol-2-yl]methanamine is sourced from PubChem (CID 113427307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).