1-(2-methoxyethyl)-N-(2,4,6-trimethylphenyl)imidazol-2-amine

C15H21N3O — CID 106555369

IUPAC1-(2-methoxyethyl)-N-(2,4,6-trimethylphenyl)imidazol-2-amine
SMILESCOCCn1ccnc1Nc1c(C)cc(C)cc1C
InChIInChI=1S/C15H21N3O/c1-11-9-12(2)14(13(3)10-11)17-15-16-5-6-18(15)7-8-19-4/h5-6,9-10H,7-8H2,1-4H3,(H,16,17)
InChIKeyBUMXXUUWZNDKKA-UHFFFAOYSA-N
MW259.35 g/mol
LogP3.20
Rot. Bonds5

About 1-(2-methoxyethyl)-N-(2,4,6-trimethylphenyl)imidazol-2-amine

1-(2-methoxyethyl)-N-(2,4,6-trimethylphenyl)imidazol-2-amine (PubChem CID 106555369) has the molecular formula C15H21N3O and a molecular weight of 259.35 g/mol. Its IUPAC name is 1-(2-methoxyethyl)-N-(2,4,6-trimethylphenyl)imidazol-2-amine.

Molecular Properties

Compound Name1-(2-methoxyethyl)-N-(2,4,6-trimethylphenyl)imidazol-2-amine
PubChem CID106555369
Molecular FormulaC15H21N3O
Molecular Weight259.35 g/mol
Exact Mass259.17
IUPAC Name1-(2-methoxyethyl)-N-(2,4,6-trimethylphenyl)imidazol-2-amine
SMILESCOCCn1ccnc1Nc1c(C)cc(C)cc1C
InChIInChI=1S/C15H21N3O/c1-11-9-12(2)14(13(3)10-11)17-15-16-5-6-18(15)7-8-19-4/h5-6,9-10H,7-8H2,1-4H3,(H,16,17)
InChIKeyBUMXXUUWZNDKKA-UHFFFAOYSA-N
XLogP3.20
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.35
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethyl)-N-(2,4,6-trimethylphenyl)imidazol-2-amine?
The IUPAC name of 1-(2-methoxyethyl)-N-(2,4,6-trimethylphenyl)imidazol-2-amine (CID 106555369) is 1-(2-methoxyethyl)-N-(2,4,6-trimethylphenyl)imidazol-2-amine.
What is the SMILES notation for 1-(2-methoxyethyl)-N-(2,4,6-trimethylphenyl)imidazol-2-amine?
The canonical SMILES for 1-(2-methoxyethyl)-N-(2,4,6-trimethylphenyl)imidazol-2-amine is COCCn1ccnc1Nc1c(C)cc(C)cc1C.
What is the InChIKey of 1-(2-methoxyethyl)-N-(2,4,6-trimethylphenyl)imidazol-2-amine?
The InChIKey is BUMXXUUWZNDKKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O/c1-11-9-12(2)14(13(3)10-11)17-15-16-5-6-18(15)7-8-19-4/h5-6,9-10H,7-8H2,1-4H3,(H,16,17).
What are the key properties of 1-(2-methoxyethyl)-N-(2,4,6-trimethylphenyl)imidazol-2-amine?
1-(2-methoxyethyl)-N-(2,4,6-trimethylphenyl)imidazol-2-amine has a molecular weight of 259.35 g/mol, XLogP of 3.20, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethyl)-N-(2,4,6-trimethylphenyl)imidazol-2-amine is sourced from PubChem (CID 106555369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).