N-ethyl-1-[2-(2-methoxyethoxy)ethyl]imidazol-2-amine

C10H19N3O2 — CID 106564453

IUPACN-ethyl-1-[2-(2-methoxyethoxy)ethyl]imidazol-2-amine
SMILESCCNc1nccn1CCOCCOC
InChIInChI=1S/C10H19N3O2/c1-3-11-10-12-4-5-13(10)6-7-15-9-8-14-2/h4-5H,3,6-9H2,1-2H3,(H,11,12)
InChIKeyHZQYKZVCFCFQKA-UHFFFAOYSA-N
MW213.28 g/mol
LogP0.98
Rot. Bonds8

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

N-ethyl-1-[2-(2-methoxyethoxy)ethyl]imidazol-2-amine (PubChem CID 106564453) has the molecular formula C10H19N3O2 and a molecular weight of 213.28 g/mol. Its IUPAC name is N-ethyl-1-[2-(2-methoxyethoxy)ethyl]imidazol-2-amine.

Molecular Properties

Compound NameN-ethyl-1-[2-(2-methoxyethoxy)ethyl]imidazol-2-amine
PubChem CID106564453
Molecular FormulaC10H19N3O2
Molecular Weight213.28 g/mol
Exact Mass213.15
IUPAC NameN-ethyl-1-[2-(2-methoxyethoxy)ethyl]imidazol-2-amine
SMILESCCNc1nccn1CCOCCOC
InChIInChI=1S/C10H19N3O2/c1-3-11-10-12-4-5-13(10)6-7-15-9-8-14-2/h4-5H,3,6-9H2,1-2H3,(H,11,12)
InChIKeyHZQYKZVCFCFQKA-UHFFFAOYSA-N
XLogP0.98
TPSA48.31 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 50.98
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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Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-[2-(2-methoxyethoxy)ethyl]imidazol-2-amine?
The IUPAC name of N-ethyl-1-[2-(2-methoxyethoxy)ethyl]imidazol-2-amine (CID 106564453) is N-ethyl-1-[2-(2-methoxyethoxy)ethyl]imidazol-2-amine.
What is the SMILES notation for N-ethyl-1-[2-(2-methoxyethoxy)ethyl]imidazol-2-amine?
The canonical SMILES for N-ethyl-1-[2-(2-methoxyethoxy)ethyl]imidazol-2-amine is CCNc1nccn1CCOCCOC.
What is the InChIKey of N-ethyl-1-[2-(2-methoxyethoxy)ethyl]imidazol-2-amine?
The InChIKey is HZQYKZVCFCFQKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O2/c1-3-11-10-12-4-5-13(10)6-7-15-9-8-14-2/h4-5H,3,6-9H2,1-2H3,(H,11,12).
What are the key properties of N-ethyl-1-[2-(2-methoxyethoxy)ethyl]imidazol-2-amine?
N-ethyl-1-[2-(2-methoxyethoxy)ethyl]imidazol-2-amine has a molecular weight of 213.28 g/mol, XLogP of 0.98, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-[2-(2-methoxyethoxy)ethyl]imidazol-2-amine is sourced from PubChem (CID 106564453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).