1-(2-methylimidazol-1-yl)-3-phenoxypropan-2-ol

C13H16N2O2 — CID 3144349

IUPAC1-(2-methylimidazol-1-yl)-3-phenoxypropan-2-ol
SMILESCc1nccn1CC(O)COc1ccccc1
InChIInChI=1S/C13H16N2O2/c1-11-14-7-8-15(11)9-12(16)10-17-13-5-3-2-4-6-13/h2-8,12,16H,9-10H2,1H3
InChIKeyRHTXCFRIEYHAHM-UHFFFAOYSA-N
MW232.28 g/mol
LogP1.63
Rot. Bonds5

About 1-(2-methylimidazol-1-yl)-3-phenoxypropan-2-ol

1-(2-methylimidazol-1-yl)-3-phenoxypropan-2-ol (PubChem CID 3144349) has the molecular formula C13H16N2O2 and a molecular weight of 232.28 g/mol. Its IUPAC name is 1-(2-methylimidazol-1-yl)-3-phenoxypropan-2-ol.

Molecular Properties

Compound Name1-(2-methylimidazol-1-yl)-3-phenoxypropan-2-ol
PubChem CID3144349
Molecular FormulaC13H16N2O2
Molecular Weight232.28 g/mol
Exact Mass232.12
IUPAC Name1-(2-methylimidazol-1-yl)-3-phenoxypropan-2-ol
SMILESCc1nccn1CC(O)COc1ccccc1
InChIInChI=1S/C13H16N2O2/c1-11-14-7-8-15(11)9-12(16)10-17-13-5-3-2-4-6-13/h2-8,12,16H,9-10H2,1H3
InChIKeyRHTXCFRIEYHAHM-UHFFFAOYSA-N
XLogP1.63
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.28
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(2-methylimidazol-1-yl)-3-phenoxypropan-2-ol with MolForge

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

Launch Full Analysis

Related Compounds

Imiloxan
CID 133621
Imiloxan hydrochloride
CID 172975
1H-Imidazole, 1-(2-phenoxyethyl)-
CID 13569172
2-Propanol, 3-(dimethylamino)-1-(6-(1-(1H-imidazol-1-yl)vinyl)phenoxy)-
CID 3069781
1-[2-(4-ethylphenoxy)ethyl]-1H-imidazole
CID 867238
1-[2-(2-Methylphenoxy)ethyl]imidazole
CID 868346
1-[2-(4-methoxyphenoxy)ethyl]-1H-imidazole
CID 868397
1-[2-(2-methoxyphenoxy)ethyl]-1H-imidazole
CID 868517
1-[3-(4-fluorophenoxy)propyl]-1H-imidazole
CID 2843814
1-(4-bromophenoxy)-3-(1H-imidazol-1-yl)propan-2-ol
CID 2953277
Cambridge id 6865961
CID 2804749
1-[3-(4-methylphenoxy)propyl]-1H-imidazole
CID 2841348

Frequently Asked Questions

What is the IUPAC name of 1-(2-methylimidazol-1-yl)-3-phenoxypropan-2-ol?
The IUPAC name of 1-(2-methylimidazol-1-yl)-3-phenoxypropan-2-ol (CID 3144349) is 1-(2-methylimidazol-1-yl)-3-phenoxypropan-2-ol.
What is the SMILES notation for 1-(2-methylimidazol-1-yl)-3-phenoxypropan-2-ol?
The canonical SMILES for 1-(2-methylimidazol-1-yl)-3-phenoxypropan-2-ol is Cc1nccn1CC(O)COc1ccccc1.
What is the InChIKey of 1-(2-methylimidazol-1-yl)-3-phenoxypropan-2-ol?
The InChIKey is RHTXCFRIEYHAHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O2/c1-11-14-7-8-15(11)9-12(16)10-17-13-5-3-2-4-6-13/h2-8,12,16H,9-10H2,1H3.
What are the key properties of 1-(2-methylimidazol-1-yl)-3-phenoxypropan-2-ol?
1-(2-methylimidazol-1-yl)-3-phenoxypropan-2-ol has a molecular weight of 232.28 g/mol, XLogP of 1.63, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylimidazol-1-yl)-3-phenoxypropan-2-ol is sourced from PubChem (CID 3144349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).