2-(azetidin-3-yl)-5-methyl-4-phenyl-1,3-oxazole

C13H14N2O — CID 105467712

IUPAC2-(azetidin-3-yl)-5-methyl-4-phenyl-1,3-oxazole
SMILESCc1oc(C2CNC2)nc1-c1ccccc1
InChIInChI=1S/C13H14N2O/c1-9-12(10-5-3-2-4-6-10)15-13(16-9)11-7-14-8-11/h2-6,11,14H,7-8H2,1H3
InChIKeyITIVLCWBKKHQKA-UHFFFAOYSA-N
MW214.27 g/mol
LogP2.34
Rot. Bonds2

About 2-(azetidin-3-yl)-5-methyl-4-phenyl-1,3-oxazole

2-(azetidin-3-yl)-5-methyl-4-phenyl-1,3-oxazole (PubChem CID 105467712) has the molecular formula C13H14N2O and a molecular weight of 214.27 g/mol. Its IUPAC name is 2-(azetidin-3-yl)-5-methyl-4-phenyl-1,3-oxazole.

Molecular Properties

Compound Name2-(azetidin-3-yl)-5-methyl-4-phenyl-1,3-oxazole
PubChem CID105467712
Molecular FormulaC13H14N2O
Molecular Weight214.27 g/mol
Exact Mass214.11
IUPAC Name2-(azetidin-3-yl)-5-methyl-4-phenyl-1,3-oxazole
SMILESCc1oc(C2CNC2)nc1-c1ccccc1
InChIInChI=1S/C13H14N2O/c1-9-12(10-5-3-2-4-6-10)15-13(16-9)11-7-14-8-11/h2-6,11,14H,7-8H2,1H3
InChIKeyITIVLCWBKKHQKA-UHFFFAOYSA-N
XLogP2.34
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.27
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(azetidin-3-yl)-5-methyl-4-phenyl-1,3-oxazole 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-(azetidin-3-yl)-5-methyl-4-(trifluoromethyl)-1,3-oxazole
CID 105458332
2-(azetidin-3-yl)-4,5-diphenyl-1H-imidazole
CID 102970117
5-methyl-2-methylsulfanyl-4-phenyl-1,3-oxazole
CID 21435653
5-chloro-6-[4-(5-methyl-4-phenyl-1,3-oxazol-2-yl)piperidin-1-yl]pyridine-3-carbonitrile
CID 99812003
5-methyl-2-methylsulfonyl-4-phenyl-1,3-oxazole
CID 21435665
5-methyl-2-phenyl-4-piperidin-4-yl-1,3-oxazole
CID 115044754
2-[(2R,4S)-4-methoxypyrrolidin-2-yl]-4,5-diphenyl-1,3-oxazole
CID 90742485
3-(azetidin-3-yl)-2-phenylpyridine;hydrochloride
CID 67469210
4-(azetidin-3-yl)-2-phenyl-1,3-oxazole
CID 105452809
1-[4-(4-phenoxyphenyl)-2-pyrrolidin-3-yl-1,3-oxazol-5-yl]ethanone
CID 122489307
2-(azetidin-3-yl)-5-(4-methylphenyl)-1,3-oxazole
CID 115028752
2-(azetidin-3-yl)-5-methyl-N-[(2-phenyltriazol-4-yl)methyl]-1,3-oxazole-4-carboxamide;2,2,2-trifluoroacetic acid
CID 167944945

Frequently Asked Questions

What is the IUPAC name of 2-(azetidin-3-yl)-5-methyl-4-phenyl-1,3-oxazole?
The IUPAC name of 2-(azetidin-3-yl)-5-methyl-4-phenyl-1,3-oxazole (CID 105467712) is 2-(azetidin-3-yl)-5-methyl-4-phenyl-1,3-oxazole.
What is the SMILES notation for 2-(azetidin-3-yl)-5-methyl-4-phenyl-1,3-oxazole?
The canonical SMILES for 2-(azetidin-3-yl)-5-methyl-4-phenyl-1,3-oxazole is Cc1oc(C2CNC2)nc1-c1ccccc1.
What is the InChIKey of 2-(azetidin-3-yl)-5-methyl-4-phenyl-1,3-oxazole?
The InChIKey is ITIVLCWBKKHQKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O/c1-9-12(10-5-3-2-4-6-10)15-13(16-9)11-7-14-8-11/h2-6,11,14H,7-8H2,1H3.
What are the key properties of 2-(azetidin-3-yl)-5-methyl-4-phenyl-1,3-oxazole?
2-(azetidin-3-yl)-5-methyl-4-phenyl-1,3-oxazole has a molecular weight of 214.27 g/mol, XLogP of 2.34, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(azetidin-3-yl)-5-methyl-4-phenyl-1,3-oxazole is sourced from PubChem (CID 105467712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).