5-(4-ethoxyphenyl)-2-methyl-1H-imidazole

C12H14N2O — CID 116883826

IUPAC5-(4-ethoxyphenyl)-2-methyl-1H-imidazole
SMILESCCOc1ccc(-c2cnc(C)[nH]2)cc1
InChIInChI=1S/C12H14N2O/c1-3-15-11-6-4-10(5-7-11)12-8-13-9(2)14-12/h4-8H,3H2,1-2H3,(H,13,14)
InChIKeySRYIFFCUNXCEPS-UHFFFAOYSA-N
MW202.26 g/mol
LogP2.78
Rot. Bonds3

About 5-(4-ethoxyphenyl)-2-methyl-1H-imidazole

5-(4-ethoxyphenyl)-2-methyl-1H-imidazole (PubChem CID 116883826) has the molecular formula C12H14N2O and a molecular weight of 202.26 g/mol. Its IUPAC name is 5-(4-ethoxyphenyl)-2-methyl-1H-imidazole.

Molecular Properties

Compound Name5-(4-ethoxyphenyl)-2-methyl-1H-imidazole
PubChem CID116883826
Molecular FormulaC12H14N2O
Molecular Weight202.26 g/mol
Exact Mass202.11
IUPAC Name5-(4-ethoxyphenyl)-2-methyl-1H-imidazole
SMILESCCOc1ccc(-c2cnc(C)[nH]2)cc1
InChIInChI=1S/C12H14N2O/c1-3-15-11-6-4-10(5-7-11)12-8-13-9(2)14-12/h4-8H,3H2,1-2H3,(H,13,14)
InChIKeySRYIFFCUNXCEPS-UHFFFAOYSA-N
XLogP2.78
TPSA37.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.26
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[4-(2-methyl-1H-imidazol-5-yl)phenoxy]ethanamine
CID 12986051
5-(4-ethoxyphenyl)-1H-imidazol-2-amine
CID 12733698
azane;2-methyl-5-(4-methylphenyl)-1H-imidazole
CID 175302356
2-methyl-5-[4-(4-methylphenyl)phenyl]-1H-imidazole
CID 118357531
5-(4-bromophenyl)-2-(4-ethoxyphenyl)-1H-imidazole
CID 174408682
2-(2-chloroethyl)-5-(4-ethoxyphenyl)-1H-imidazole
CID 116878190
1-[5-(4-ethoxyphenyl)-1H-imidazol-2-yl]-2-methylpropan-1-amine
CID 43651379
5-[5-(4-ethoxyphenyl)-1H-imidazol-2-yl]-2-(methoxymethyl)pyrimidine
CID 50980448
3-[5-(4-ethoxyphenyl)-1H-imidazol-2-yl]phenol
CID 50980518
N-[[5-(4-ethoxyphenyl)-1H-imidazol-2-yl]methyl]cyclopropanamine
CID 60842321
2-methyl-5-(2-methyl-1H-imidazol-5-yl)pyridine
CID 90181960
5-(4-ethoxyphenyl)-2-pyrrolidin-2-yl-1H-imidazole
CID 43650691

Frequently Asked Questions

What is the IUPAC name of 5-(4-ethoxyphenyl)-2-methyl-1H-imidazole?
The IUPAC name of 5-(4-ethoxyphenyl)-2-methyl-1H-imidazole (CID 116883826) is 5-(4-ethoxyphenyl)-2-methyl-1H-imidazole.
What is the SMILES notation for 5-(4-ethoxyphenyl)-2-methyl-1H-imidazole?
The canonical SMILES for 5-(4-ethoxyphenyl)-2-methyl-1H-imidazole is CCOc1ccc(-c2cnc(C)[nH]2)cc1.
What is the InChIKey of 5-(4-ethoxyphenyl)-2-methyl-1H-imidazole?
The InChIKey is SRYIFFCUNXCEPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O/c1-3-15-11-6-4-10(5-7-11)12-8-13-9(2)14-12/h4-8H,3H2,1-2H3,(H,13,14).
What are the key properties of 5-(4-ethoxyphenyl)-2-methyl-1H-imidazole?
5-(4-ethoxyphenyl)-2-methyl-1H-imidazole has a molecular weight of 202.26 g/mol, XLogP of 2.78, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-ethoxyphenyl)-2-methyl-1H-imidazole is sourced from PubChem (CID 116883826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).