4-(5-ethyl-2-methyl-1H-imidazol-4-yl)phenol

C12H14N2O — CID 105454397

IUPAC4-(5-ethyl-2-methyl-1H-imidazol-4-yl)phenol
SMILESCCc1[nH]c(C)nc1-c1ccc(O)cc1
InChIInChI=1S/C12H14N2O/c1-3-11-12(14-8(2)13-11)9-4-6-10(15)7-5-9/h4-7,15H,3H2,1-2H3,(H,13,14)
InChIKeyALZPZXNNBKHIKP-UHFFFAOYSA-N
MW202.26 g/mol
LogP2.65
Rot. Bonds2

About 4-(5-ethyl-2-methyl-1H-imidazol-4-yl)phenol

4-(5-ethyl-2-methyl-1H-imidazol-4-yl)phenol (PubChem CID 105454397) has the molecular formula C12H14N2O and a molecular weight of 202.26 g/mol. Its IUPAC name is 4-(5-ethyl-2-methyl-1H-imidazol-4-yl)phenol.

Molecular Properties

Compound Name4-(5-ethyl-2-methyl-1H-imidazol-4-yl)phenol
PubChem CID105454397
Molecular FormulaC12H14N2O
Molecular Weight202.26 g/mol
Exact Mass202.11
IUPAC Name4-(5-ethyl-2-methyl-1H-imidazol-4-yl)phenol
SMILESCCc1[nH]c(C)nc1-c1ccc(O)cc1
InChIInChI=1S/C12H14N2O/c1-3-11-12(14-8(2)13-11)9-4-6-10(15)7-5-9/h4-7,15H,3H2,1-2H3,(H,13,14)
InChIKeyALZPZXNNBKHIKP-UHFFFAOYSA-N
XLogP2.65
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.26
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 4-(5-ethyl-2-methyl-1H-imidazol-4-yl)phenol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-(5-ethyl-2-methyl-1H-imidazol-4-yl)phenol?
The IUPAC name of 4-(5-ethyl-2-methyl-1H-imidazol-4-yl)phenol (CID 105454397) is 4-(5-ethyl-2-methyl-1H-imidazol-4-yl)phenol.
What is the SMILES notation for 4-(5-ethyl-2-methyl-1H-imidazol-4-yl)phenol?
The canonical SMILES for 4-(5-ethyl-2-methyl-1H-imidazol-4-yl)phenol is CCc1[nH]c(C)nc1-c1ccc(O)cc1.
What is the InChIKey of 4-(5-ethyl-2-methyl-1H-imidazol-4-yl)phenol?
The InChIKey is ALZPZXNNBKHIKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O/c1-3-11-12(14-8(2)13-11)9-4-6-10(15)7-5-9/h4-7,15H,3H2,1-2H3,(H,13,14).
What are the key properties of 4-(5-ethyl-2-methyl-1H-imidazol-4-yl)phenol?
4-(5-ethyl-2-methyl-1H-imidazol-4-yl)phenol has a molecular weight of 202.26 g/mol, XLogP of 2.65, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-ethyl-2-methyl-1H-imidazol-4-yl)phenol is sourced from PubChem (CID 105454397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).