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

C16H20N2O2 — CID 102676753

IUPAC2-[cyclobutyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]ethanol
SMILESOCCN(Cc1cc(-c2ccccc2)no1)C1CCC1
InChIInChI=1S/C16H20N2O2/c19-10-9-18(14-7-4-8-14)12-15-11-16(17-20-15)13-5-2-1-3-6-13/h1-3,5-6,11,14,19H,4,7-10,12H2
InChIKeyBYFOQNDRYQGAMA-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.69
Rot. Bonds6

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

2-[cyclobutyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]ethanol (PubChem CID 102676753) has the molecular formula C16H20N2O2 and a molecular weight of 272.35 g/mol. Its IUPAC name is 2-[cyclobutyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]ethanol.

Molecular Properties

Compound Name2-[cyclobutyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]ethanol
PubChem CID102676753
Molecular FormulaC16H20N2O2
Molecular Weight272.35 g/mol
Exact Mass272.15
IUPAC Name2-[cyclobutyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]ethanol
SMILESOCCN(Cc1cc(-c2ccccc2)no1)C1CCC1
InChIInChI=1S/C16H20N2O2/c19-10-9-18(14-7-4-8-14)12-15-11-16(17-20-15)13-5-2-1-3-6-13/h1-3,5-6,11,14,19H,4,7-10,12H2
InChIKeyBYFOQNDRYQGAMA-UHFFFAOYSA-N
XLogP2.69
TPSA49.50 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-[cyclobutyl-[(3-phenyl-1,2-oxazol-5-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

2-[2-hydroxyethyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]ethanol
CID 62021320
N-(1,3-benzodioxol-5-ylmethyl)-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]cyclopentanamine
CID 30588730
2-[cyclopropyl-[[3-(4-methylphenyl)-1,2-oxazol-5-yl]methyl]amino]acetic acid
CID 60833551
N,N-dimethyl-1-(3-phenyl-1,2-oxazol-5-yl)methanamine
CID 15761396
2-[cyclobutyl-[[5-(3-methylphenyl)-1,2,4-oxadiazol-3-yl]methyl]amino]ethanol
CID 102677089
(3R,4S)-4-[ethyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]oxolan-3-ol
CID 77085335
2-[cyclohexyl(furan-2-ylmethyl)amino]ethanol
CID 62016796
2-[(3-benzyl-1,2,4-oxadiazol-5-yl)methyl-cyclohexylamino]ethanol
CID 110908622
N-methyl-1-[(2R)-oxan-2-yl]-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]methanamine
CID 99613583
N'-methyl-N'-[(3-phenyl-1,2-oxazol-5-yl)methyl]ethane-1,2-diamine
CID 62686446
2-[cyclobutyl-[(5-methylfuran-2-yl)methyl]amino]ethanol
CID 102680065
2-[[5-(4-chlorophenyl)-1,2,4-oxadiazol-3-yl]methyl-cyclobutylamino]ethanol
CID 102677203

Frequently Asked Questions

What is the IUPAC name of 2-[cyclobutyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]ethanol?
The IUPAC name of 2-[cyclobutyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]ethanol (CID 102676753) is 2-[cyclobutyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]ethanol.
What is the SMILES notation for 2-[cyclobutyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]ethanol?
The canonical SMILES for 2-[cyclobutyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]ethanol is OCCN(Cc1cc(-c2ccccc2)no1)C1CCC1.
What is the InChIKey of 2-[cyclobutyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]ethanol?
The InChIKey is BYFOQNDRYQGAMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O2/c19-10-9-18(14-7-4-8-14)12-15-11-16(17-20-15)13-5-2-1-3-6-13/h1-3,5-6,11,14,19H,4,7-10,12H2.
What are the key properties of 2-[cyclobutyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]ethanol?
2-[cyclobutyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]ethanol has a molecular weight of 272.35 g/mol, XLogP of 2.69, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclobutyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]ethanol is sourced from PubChem (CID 102676753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).