2-(azetidin-3-yl)-5-(2-methoxyphenyl)-1,3-oxazole

C13H14N2O2 — CID 115037712

IUPAC2-(azetidin-3-yl)-5-(2-methoxyphenyl)-1,3-oxazole
SMILESCOc1ccccc1-c1cnc(C2CNC2)o1
InChIInChI=1S/C13H14N2O2/c1-16-11-5-3-2-4-10(11)12-8-15-13(17-12)9-6-14-7-9/h2-5,8-9,14H,6-7H2,1H3
InChIKeyZTSDLMMVNSRWKJ-UHFFFAOYSA-N
MW230.27 g/mol
LogP2.04
Rot. Bonds3

About 2-(azetidin-3-yl)-5-(2-methoxyphenyl)-1,3-oxazole

2-(azetidin-3-yl)-5-(2-methoxyphenyl)-1,3-oxazole (PubChem CID 115037712) has the molecular formula C13H14N2O2 and a molecular weight of 230.27 g/mol. Its IUPAC name is 2-(azetidin-3-yl)-5-(2-methoxyphenyl)-1,3-oxazole.

Molecular Properties

Compound Name2-(azetidin-3-yl)-5-(2-methoxyphenyl)-1,3-oxazole
PubChem CID115037712
Molecular FormulaC13H14N2O2
Molecular Weight230.27 g/mol
Exact Mass230.11
IUPAC Name2-(azetidin-3-yl)-5-(2-methoxyphenyl)-1,3-oxazole
SMILESCOc1ccccc1-c1cnc(C2CNC2)o1
InChIInChI=1S/C13H14N2O2/c1-16-11-5-3-2-4-10(11)12-8-15-13(17-12)9-6-14-7-9/h2-5,8-9,14H,6-7H2,1H3
InChIKeyZTSDLMMVNSRWKJ-UHFFFAOYSA-N
XLogP2.04
TPSA47.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(azetidin-3-ylmethyl)-5-(2-methoxyphenyl)-1,3-oxazole
CID 115045283
2-(azetidin-3-yl)-5-(4-methylphenyl)-1,3-oxazole
CID 115028752
2-(2-pyrrolidin-3-yl-1,3-oxazol-5-yl)phenol
CID 84693433
2-tert-butyl-5-(2-methoxyphenyl)-1,3-oxazole
CID 154771329
N-[2-[5-(2-methoxyphenyl)-1,3-oxazol-2-yl]ethyl]cyclopropanamine
CID 65182442
2-(2-methoxyphenyl)-5-piperidin-3-yl-1,3,4-oxadiazole
CID 82044862
2-(3-chloropropyl)-5-(2-methoxyphenyl)-1,3-oxazole
CID 65180005
2-(azetidin-3-yl)-3-methoxypyridine
CID 130160263
N-ethyl-2-[5-(2-methoxyphenyl)-1,3-oxazol-2-yl]ethanamine
CID 65182800
2-(2-methoxyphenyl)-3-[(3S)-piperidin-3-yl]pyrazine
CID 95816648
2-(2-methoxyphenyl)-4-pyrrolidin-3-yl-1,3-oxazole
CID 115045278
4-(2-methoxyphenyl)-5-piperidin-4-yl-1,2-oxazole
CID 115003498

Frequently Asked Questions

What is the IUPAC name of 2-(azetidin-3-yl)-5-(2-methoxyphenyl)-1,3-oxazole?
The IUPAC name of 2-(azetidin-3-yl)-5-(2-methoxyphenyl)-1,3-oxazole (CID 115037712) is 2-(azetidin-3-yl)-5-(2-methoxyphenyl)-1,3-oxazole.
What is the SMILES notation for 2-(azetidin-3-yl)-5-(2-methoxyphenyl)-1,3-oxazole?
The canonical SMILES for 2-(azetidin-3-yl)-5-(2-methoxyphenyl)-1,3-oxazole is COc1ccccc1-c1cnc(C2CNC2)o1.
What is the InChIKey of 2-(azetidin-3-yl)-5-(2-methoxyphenyl)-1,3-oxazole?
The InChIKey is ZTSDLMMVNSRWKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O2/c1-16-11-5-3-2-4-10(11)12-8-15-13(17-12)9-6-14-7-9/h2-5,8-9,14H,6-7H2,1H3.
What are the key properties of 2-(azetidin-3-yl)-5-(2-methoxyphenyl)-1,3-oxazole?
2-(azetidin-3-yl)-5-(2-methoxyphenyl)-1,3-oxazole has a molecular weight of 230.27 g/mol, XLogP of 2.04, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(azetidin-3-yl)-5-(2-methoxyphenyl)-1,3-oxazole is sourced from PubChem (CID 115037712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).