2-[methyl-[(5-phenyl-1,2-oxazol-3-yl)methyl]amino]ethanol

C13H16N2O2 — CID 60683924

IUPAC2-[methyl-[(5-phenyl-1,2-oxazol-3-yl)methyl]amino]ethanol
SMILESCN(CCO)Cc1cc(-c2ccccc2)on1
InChIInChI=1S/C13H16N2O2/c1-15(7-8-16)10-12-9-13(17-14-12)11-5-3-2-4-6-11/h2-6,9,16H,7-8,10H2,1H3
InChIKeyPIJJYAXJUKRSHR-UHFFFAOYSA-N
MW232.28 g/mol
LogP1.77
Rot. Bonds5

About 2-[methyl-[(5-phenyl-1,2-oxazol-3-yl)methyl]amino]ethanol

2-[methyl-[(5-phenyl-1,2-oxazol-3-yl)methyl]amino]ethanol (PubChem CID 60683924) has the molecular formula C13H16N2O2 and a molecular weight of 232.28 g/mol. Its IUPAC name is 2-[methyl-[(5-phenyl-1,2-oxazol-3-yl)methyl]amino]ethanol.

Molecular Properties

Compound Name2-[methyl-[(5-phenyl-1,2-oxazol-3-yl)methyl]amino]ethanol
PubChem CID60683924
Molecular FormulaC13H16N2O2
Molecular Weight232.28 g/mol
Exact Mass232.12
IUPAC Name2-[methyl-[(5-phenyl-1,2-oxazol-3-yl)methyl]amino]ethanol
SMILESCN(CCO)Cc1cc(-c2ccccc2)on1
InChIInChI=1S/C13H16N2O2/c1-15(7-8-16)10-12-9-13(17-14-12)11-5-3-2-4-6-11/h2-6,9,16H,7-8,10H2,1H3
InChIKeyPIJJYAXJUKRSHR-UHFFFAOYSA-N
XLogP1.77
TPSA49.50 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 ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-[methyl-[(5-phenyl-1,2-oxazol-3-yl)methyl]amino]ethanol 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

3-[methyl-[(5-phenyl-1,2-oxazol-3-yl)methyl]amino]propanoic acid
CID 60988202
2-[(5-phenyl-1,2-oxazol-3-yl)methyl-propylamino]ethanol
CID 60693417
1-[[methyl-[(5-phenyl-1,2-oxazol-3-yl)methyl]amino]methyl]cyclopentan-1-ol
CID 114952613
N-[(5-phenyl-1,2-oxazol-3-yl)methyl]-N-propylacetamide
CID 42656369
3-[ethyl-[(5-phenyl-1,2-oxazol-3-yl)methyl]amino]propanoic acid
CID 61009666
3-[methyl-[(5-phenyl-1,2-oxazol-3-yl)methyl]amino]-1-[(3S)-3-methylpiperidin-1-yl]propan-1-one
CID 95147475
N-(4-chlorophenyl)-2-[methyl-[(5-phenyl-1,2-oxazol-3-yl)methyl]amino]acetamide
CID 8815901
2-[(5-phenyl-1,2-oxazol-3-yl)methyl-propan-2-ylamino]acetic acid
CID 60840315
2-[ethyl-[(5-phenyl-1,2-oxazol-3-yl)methyl]amino]-2-methylpropanoic acid
CID 62820490
N-[(1-ethylimidazol-2-yl)methyl]-N-methyl-1-(5-phenyl-1,2-oxazol-3-yl)methanamine
CID 77084710
3-[ethyl-[(5-phenyl-1,2-oxazol-3-yl)methyl]amino]butanoic acid
CID 62825872
3-(5-phenyl-1,2-oxazol-3-yl)propanoic acid
CID 53414694

Frequently Asked Questions

What is the IUPAC name of 2-[methyl-[(5-phenyl-1,2-oxazol-3-yl)methyl]amino]ethanol?
The IUPAC name of 2-[methyl-[(5-phenyl-1,2-oxazol-3-yl)methyl]amino]ethanol (CID 60683924) is 2-[methyl-[(5-phenyl-1,2-oxazol-3-yl)methyl]amino]ethanol.
What is the SMILES notation for 2-[methyl-[(5-phenyl-1,2-oxazol-3-yl)methyl]amino]ethanol?
The canonical SMILES for 2-[methyl-[(5-phenyl-1,2-oxazol-3-yl)methyl]amino]ethanol is CN(CCO)Cc1cc(-c2ccccc2)on1.
What is the InChIKey of 2-[methyl-[(5-phenyl-1,2-oxazol-3-yl)methyl]amino]ethanol?
The InChIKey is PIJJYAXJUKRSHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O2/c1-15(7-8-16)10-12-9-13(17-14-12)11-5-3-2-4-6-11/h2-6,9,16H,7-8,10H2,1H3.
What are the key properties of 2-[methyl-[(5-phenyl-1,2-oxazol-3-yl)methyl]amino]ethanol?
2-[methyl-[(5-phenyl-1,2-oxazol-3-yl)methyl]amino]ethanol has a molecular weight of 232.28 g/mol, XLogP of 1.77, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl-[(5-phenyl-1,2-oxazol-3-yl)methyl]amino]ethanol is sourced from PubChem (CID 60683924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).