5-(4-methoxyphenyl)-1-methyl-N-[(E)-3-phenylprop-2-enyl]imidazol-2-amine

C20H21N3O — CID 45147014

IUPAC5-(4-methoxyphenyl)-1-methyl-N-[(E)-3-phenylprop-2-enyl]imidazol-2-amine
SMILESCOc1ccc(-c2cnc(NC/C=C/c3ccccc3)n2C)cc1
InChIInChI=1S/C20H21N3O/c1-23-19(17-10-12-18(24-2)13-11-17)15-22-20(23)21-14-6-9-16-7-4-3-5-8-16/h3-13,15H,14H2,1-2H3,(H,21,22)/b9-6+
InChIKeyGYHJFYNQFKIZPQ-RMKNXTFCSA-N
MW319.41 g/mol
LogP4.22
Rot. Bonds6

About 5-(4-methoxyphenyl)-1-methyl-N-[(E)-3-phenylprop-2-enyl]imidazol-2-amine

5-(4-methoxyphenyl)-1-methyl-N-[(E)-3-phenylprop-2-enyl]imidazol-2-amine (PubChem CID 45147014) has the molecular formula C20H21N3O and a molecular weight of 319.41 g/mol. Its IUPAC name is 5-(4-methoxyphenyl)-1-methyl-N-[(E)-3-phenylprop-2-enyl]imidazol-2-amine.

Molecular Properties

Compound Name5-(4-methoxyphenyl)-1-methyl-N-[(E)-3-phenylprop-2-enyl]imidazol-2-amine
PubChem CID45147014
Molecular FormulaC20H21N3O
Molecular Weight319.41 g/mol
Exact Mass319.17
IUPAC Name5-(4-methoxyphenyl)-1-methyl-N-[(E)-3-phenylprop-2-enyl]imidazol-2-amine
SMILESCOc1ccc(-c2cnc(NC/C=C/c3ccccc3)n2C)cc1
InChIInChI=1S/C20H21N3O/c1-23-19(17-10-12-18(24-2)13-11-17)15-22-20(23)21-14-6-9-16-7-4-3-5-8-16/h3-13,15H,14H2,1-2H3,(H,21,22)/b9-6+
InChIKeyGYHJFYNQFKIZPQ-RMKNXTFCSA-N
XLogP4.22
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.41
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[5-(4-methoxyphenyl)-1-methylimidazol-2-yl]benzamide
CID 1096852
5-(4-bromophenyl)-N-[(4-methoxyphenyl)methyl]-1-methylimidazol-2-amine
CID 4000715
5-(4-methoxyphenyl)-1-methyl-N-[(2-methyl-1,2,4-triazol-3-yl)methyl]imidazol-2-amine
CID 138040977
1-methyl-5-(4-phenylphenyl)-N-[(3,4,5-trimethoxyphenyl)methyl]imidazol-2-amine
CID 4268293
2,4-dimethoxy-N-[(E)-3-phenylprop-2-enyl]aniline
CID 11414530
2-[[[1-methyl-5-(4-phenylphenyl)imidazol-2-yl]amino]methyl]phenol
CID 3533703
2-chloro-5-methoxy-N-(3-phenylprop-2-enyl)aniline
CID 76997582
5-(4-methoxyphenyl)-1-methylimidazole-2-carbaldehyde
CID 84681714
5-(4-bromophenyl)-N-[(3-methoxyphenyl)methyl]-1-methylimidazol-2-amine;oxalic acid
CID 126460429
2-[5-(4-methoxyphenyl)-1-methylimidazol-2-yl]sulfonyl-N-phenylacetamide
CID 18572074
4-ethoxy-N-(3-phenylprop-2-enyl)aniline
CID 4202531
5-(4-methoxyphenyl)-2-[(E)-2-phenylethenyl]-1,3-oxazole
CID 12639615

Frequently Asked Questions

What is the IUPAC name of 5-(4-methoxyphenyl)-1-methyl-N-[(E)-3-phenylprop-2-enyl]imidazol-2-amine?
The IUPAC name of 5-(4-methoxyphenyl)-1-methyl-N-[(E)-3-phenylprop-2-enyl]imidazol-2-amine (CID 45147014) is 5-(4-methoxyphenyl)-1-methyl-N-[(E)-3-phenylprop-2-enyl]imidazol-2-amine.
What is the SMILES notation for 5-(4-methoxyphenyl)-1-methyl-N-[(E)-3-phenylprop-2-enyl]imidazol-2-amine?
The canonical SMILES for 5-(4-methoxyphenyl)-1-methyl-N-[(E)-3-phenylprop-2-enyl]imidazol-2-amine is COc1ccc(-c2cnc(NC/C=C/c3ccccc3)n2C)cc1.
What is the InChIKey of 5-(4-methoxyphenyl)-1-methyl-N-[(E)-3-phenylprop-2-enyl]imidazol-2-amine?
The InChIKey is GYHJFYNQFKIZPQ-RMKNXTFCSA-N. The full InChI is InChI=1S/C20H21N3O/c1-23-19(17-10-12-18(24-2)13-11-17)15-22-20(23)21-14-6-9-16-7-4-3-5-8-16/h3-13,15H,14H2,1-2H3,(H,21,22)/b9-6+.
What are the key properties of 5-(4-methoxyphenyl)-1-methyl-N-[(E)-3-phenylprop-2-enyl]imidazol-2-amine?
5-(4-methoxyphenyl)-1-methyl-N-[(E)-3-phenylprop-2-enyl]imidazol-2-amine has a molecular weight of 319.41 g/mol, XLogP of 4.22, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-methoxyphenyl)-1-methyl-N-[(E)-3-phenylprop-2-enyl]imidazol-2-amine is sourced from PubChem (CID 45147014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).