5-(2-ethoxyphenyl)-2-methyl-3-prop-2-enylimidazol-4-amine

C15H19N3O — CID 62225255

IUPAC5-(2-ethoxyphenyl)-2-methyl-3-prop-2-enylimidazol-4-amine
SMILESC=CCn1c(C)nc(-c2ccccc2OCC)c1N
InChIInChI=1S/C15H19N3O/c1-4-10-18-11(3)17-14(15(18)16)12-8-6-7-9-13(12)19-5-2/h4,6-9H,1,5,10,16H2,2-3H3
InChIKeyRFAKJSTYXCVYKM-UHFFFAOYSA-N
MW257.34 g/mol
LogP3.03
Rot. Bonds5

About 5-(2-ethoxyphenyl)-2-methyl-3-prop-2-enylimidazol-4-amine

5-(2-ethoxyphenyl)-2-methyl-3-prop-2-enylimidazol-4-amine (PubChem CID 62225255) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is 5-(2-ethoxyphenyl)-2-methyl-3-prop-2-enylimidazol-4-amine.

Molecular Properties

Compound Name5-(2-ethoxyphenyl)-2-methyl-3-prop-2-enylimidazol-4-amine
PubChem CID62225255
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC Name5-(2-ethoxyphenyl)-2-methyl-3-prop-2-enylimidazol-4-amine
SMILESC=CCn1c(C)nc(-c2ccccc2OCC)c1N
InChIInChI=1S/C15H19N3O/c1-4-10-18-11(3)17-14(15(18)16)12-8-6-7-9-13(12)19-5-2/h4,6-9H,1,5,10,16H2,2-3H3
InChIKeyRFAKJSTYXCVYKM-UHFFFAOYSA-N
XLogP3.03
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

5-(2-fluorophenyl)-2-methyl-3-prop-2-enylimidazol-4-amine
CID 53275761
2-methyl-5-naphthalen-1-yl-3-prop-2-enylimidazol-4-amine
CID 62224177
5-(2,4-dimethoxyphenyl)-2-methyl-3-prop-2-enylimidazol-4-amine
CID 62224887
5-(2-ethoxyphenyl)-3-ethyl-2-propan-2-ylimidazol-4-amine
CID 62219790
5-(5-bromo-2-methoxyphenyl)-2-methyl-3-prop-2-enylimidazol-4-amine
CID 62224005
5-(4-ethylphenyl)-2-methyl-3-prop-2-enylimidazol-4-amine
CID 55048395
2-methyl-3-prop-2-enyl-5-(3-propoxyphenyl)imidazol-4-amine
CID 62498321
2-methyl-3-prop-2-enyl-5-pyridin-3-ylimidazol-4-amine
CID 62224002
2-cyclopropyl-5-(2-methylphenyl)-3-prop-2-enylimidazol-4-amine
CID 55048790
5-(4-methoxy-3-methylphenyl)-2-methyl-3-prop-2-enylimidazol-4-amine
CID 62224174
5-(3,5-dimethylphenyl)-2-methyl-3-prop-2-enylimidazol-4-amine
CID 62225256
2-cyclopropyl-4-(2-ethoxyphenyl)imidazole-1,5-diamine
CID 62482562

Frequently Asked Questions

What is the IUPAC name of 5-(2-ethoxyphenyl)-2-methyl-3-prop-2-enylimidazol-4-amine?
The IUPAC name of 5-(2-ethoxyphenyl)-2-methyl-3-prop-2-enylimidazol-4-amine (CID 62225255) is 5-(2-ethoxyphenyl)-2-methyl-3-prop-2-enylimidazol-4-amine.
What is the SMILES notation for 5-(2-ethoxyphenyl)-2-methyl-3-prop-2-enylimidazol-4-amine?
The canonical SMILES for 5-(2-ethoxyphenyl)-2-methyl-3-prop-2-enylimidazol-4-amine is C=CCn1c(C)nc(-c2ccccc2OCC)c1N.
What is the InChIKey of 5-(2-ethoxyphenyl)-2-methyl-3-prop-2-enylimidazol-4-amine?
The InChIKey is RFAKJSTYXCVYKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-4-10-18-11(3)17-14(15(18)16)12-8-6-7-9-13(12)19-5-2/h4,6-9H,1,5,10,16H2,2-3H3.
What are the key properties of 5-(2-ethoxyphenyl)-2-methyl-3-prop-2-enylimidazol-4-amine?
5-(2-ethoxyphenyl)-2-methyl-3-prop-2-enylimidazol-4-amine has a molecular weight of 257.34 g/mol, XLogP of 3.03, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-ethoxyphenyl)-2-methyl-3-prop-2-enylimidazol-4-amine is sourced from PubChem (CID 62225255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).