4-[2-(hydroxymethyl)-5-methyl-1H-imidazol-4-yl]phenol

C11H12N2O2 — CID 105456043

IUPAC4-[2-(hydroxymethyl)-5-methyl-1H-imidazol-4-yl]phenol
SMILESCc1[nH]c(CO)nc1-c1ccc(O)cc1
InChIInChI=1S/C11H12N2O2/c1-7-11(13-10(6-14)12-7)8-2-4-9(15)5-3-8/h2-5,14-15H,6H2,1H3,(H,12,13)
InChIKeyDLARDKJBMYYDRK-UHFFFAOYSA-N
MW204.23 g/mol
LogP1.58
Rot. Bonds2

About 4-[2-(hydroxymethyl)-5-methyl-1H-imidazol-4-yl]phenol

4-[2-(hydroxymethyl)-5-methyl-1H-imidazol-4-yl]phenol (PubChem CID 105456043) has the molecular formula C11H12N2O2 and a molecular weight of 204.23 g/mol. Its IUPAC name is 4-[2-(hydroxymethyl)-5-methyl-1H-imidazol-4-yl]phenol.

Molecular Properties

Compound Name4-[2-(hydroxymethyl)-5-methyl-1H-imidazol-4-yl]phenol
PubChem CID105456043
Molecular FormulaC11H12N2O2
Molecular Weight204.23 g/mol
Exact Mass204.09
IUPAC Name4-[2-(hydroxymethyl)-5-methyl-1H-imidazol-4-yl]phenol
SMILESCc1[nH]c(CO)nc1-c1ccc(O)cc1
InChIInChI=1S/C11H12N2O2/c1-7-11(13-10(6-14)12-7)8-2-4-9(15)5-3-8/h2-5,14-15H,6H2,1H3,(H,12,13)
InChIKeyDLARDKJBMYYDRK-UHFFFAOYSA-N
XLogP1.58
TPSA69.14 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.23
LogP ≤ 51.58
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

4-[2-(2-aminoethyl)-5-methyl-1H-imidazol-4-yl]phenol
CID 105471255
4-[4-(hydroxymethyl)-5-methyl-1H-imidazol-2-yl]phenol
CID 135671336
[5-ethyl-4-(4-methylphenyl)-1H-imidazol-2-yl]methanol
CID 105470027
[4-(4-fluorophenyl)-5-methyl-1H-imidazol-2-yl]methanamine
CID 43649221
4-[2-(azetidin-3-yl)-5-methyl-1H-imidazol-4-yl]phenol
CID 105486703
(5-methyl-4-phenyl-1H-imidazol-2-yl)methanamine
CID 43649240
4-[2-(aminomethyl)-5-methyl-1H-imidazol-4-yl]-N,N-dimethylaniline
CID 82474486
4-(5-ethyl-2-methyl-1H-imidazol-4-yl)phenol
CID 105454397
4-[2-(hydroxymethyl)-5-methyl-1,3-thiazol-4-yl]phenol
CID 105477646
3-(5-methyl-4-phenyl-1H-imidazol-2-yl)propanoic acid
CID 82474293
2-[5-methyl-4-(4-phenylphenyl)-1H-imidazol-2-yl]ethylcarbamic acid
CID 68888401
N-[[5-methyl-4-(4-methylphenyl)-1H-imidazol-2-yl]methyl]aniline
CID 60861436

Frequently Asked Questions

What is the IUPAC name of 4-[2-(hydroxymethyl)-5-methyl-1H-imidazol-4-yl]phenol?
The IUPAC name of 4-[2-(hydroxymethyl)-5-methyl-1H-imidazol-4-yl]phenol (CID 105456043) is 4-[2-(hydroxymethyl)-5-methyl-1H-imidazol-4-yl]phenol.
What is the SMILES notation for 4-[2-(hydroxymethyl)-5-methyl-1H-imidazol-4-yl]phenol?
The canonical SMILES for 4-[2-(hydroxymethyl)-5-methyl-1H-imidazol-4-yl]phenol is Cc1[nH]c(CO)nc1-c1ccc(O)cc1.
What is the InChIKey of 4-[2-(hydroxymethyl)-5-methyl-1H-imidazol-4-yl]phenol?
The InChIKey is DLARDKJBMYYDRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O2/c1-7-11(13-10(6-14)12-7)8-2-4-9(15)5-3-8/h2-5,14-15H,6H2,1H3,(H,12,13).
What are the key properties of 4-[2-(hydroxymethyl)-5-methyl-1H-imidazol-4-yl]phenol?
4-[2-(hydroxymethyl)-5-methyl-1H-imidazol-4-yl]phenol has a molecular weight of 204.23 g/mol, XLogP of 1.58, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(hydroxymethyl)-5-methyl-1H-imidazol-4-yl]phenol is sourced from PubChem (CID 105456043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).