5-(3-methylphenyl)-2-piperidin-3-yl-4,5-dihydro-1,3-oxazole

C15H20N2O — CID 115061345

IUPAC5-(3-methylphenyl)-2-piperidin-3-yl-4,5-dihydro-1,3-oxazole
SMILESCc1cccc(C2CN=C(C3CCCNC3)O2)c1
InChIInChI=1S/C15H20N2O/c1-11-4-2-5-12(8-11)14-10-17-15(18-14)13-6-3-7-16-9-13/h2,4-5,8,13-14,16H,3,6-7,9-10H2,1H3
InChIKeyRZKDJQVIGREYSG-UHFFFAOYSA-N
MW244.34 g/mol
LogP2.46
Rot. Bonds2

About 5-(3-methylphenyl)-2-piperidin-3-yl-4,5-dihydro-1,3-oxazole

5-(3-methylphenyl)-2-piperidin-3-yl-4,5-dihydro-1,3-oxazole (PubChem CID 115061345) has the molecular formula C15H20N2O and a molecular weight of 244.34 g/mol. Its IUPAC name is 5-(3-methylphenyl)-2-piperidin-3-yl-4,5-dihydro-1,3-oxazole.

Molecular Properties

Compound Name5-(3-methylphenyl)-2-piperidin-3-yl-4,5-dihydro-1,3-oxazole
PubChem CID115061345
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC Name5-(3-methylphenyl)-2-piperidin-3-yl-4,5-dihydro-1,3-oxazole
SMILESCc1cccc(C2CN=C(C3CCCNC3)O2)c1
InChIInChI=1S/C15H20N2O/c1-11-4-2-5-12(8-11)14-10-17-15(18-14)13-6-3-7-16-9-13/h2,4-5,8,13-14,16H,3,6-7,9-10H2,1H3
InChIKeyRZKDJQVIGREYSG-UHFFFAOYSA-N
XLogP2.46
TPSA33.62 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(3-methoxyphenyl)-2-piperidin-3-yl-4,5-dihydro-1,3-oxazole
CID 115061350
3-(2-pyrrolidin-3-yl-4,5-dihydro-1,3-oxazol-5-yl)phenol
CID 84695684
5-(2-chlorophenyl)-2-piperidin-3-yl-4,5-dihydro-1,3-oxazole
CID 115061354
5-(3-chlorophenyl)-2-piperidin-4-yl-4,5-dihydro-1,3-oxazole
CID 115061491
4-(2-pyrrolidin-3-yl-4,5-dihydro-1,3-oxazol-5-yl)phenol
CID 84695685
(2R)-2-(3-methylphenyl)morpholine
CID 42182782
2-(3-methylphenyl)morpholine;hydrochloride
CID 71398912
3-[3-(2,2-dimethyl-1,3-dioxolan-4-yl)phenyl]piperidine
CID 117408145
3-(2,4-dimethylphenyl)piperidine
CID 10535662
3-(3-fluoro-5-methylphenyl)piperidine
CID 79003681
3-piperidin-3-ylbenzenethiol
CID 116988736
3-[3-(4-methylpyrazol-1-yl)phenyl]piperidine
CID 117355761

Frequently Asked Questions

What is the IUPAC name of 5-(3-methylphenyl)-2-piperidin-3-yl-4,5-dihydro-1,3-oxazole?
The IUPAC name of 5-(3-methylphenyl)-2-piperidin-3-yl-4,5-dihydro-1,3-oxazole (CID 115061345) is 5-(3-methylphenyl)-2-piperidin-3-yl-4,5-dihydro-1,3-oxazole.
What is the SMILES notation for 5-(3-methylphenyl)-2-piperidin-3-yl-4,5-dihydro-1,3-oxazole?
The canonical SMILES for 5-(3-methylphenyl)-2-piperidin-3-yl-4,5-dihydro-1,3-oxazole is Cc1cccc(C2CN=C(C3CCCNC3)O2)c1.
What is the InChIKey of 5-(3-methylphenyl)-2-piperidin-3-yl-4,5-dihydro-1,3-oxazole?
The InChIKey is RZKDJQVIGREYSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O/c1-11-4-2-5-12(8-11)14-10-17-15(18-14)13-6-3-7-16-9-13/h2,4-5,8,13-14,16H,3,6-7,9-10H2,1H3.
What are the key properties of 5-(3-methylphenyl)-2-piperidin-3-yl-4,5-dihydro-1,3-oxazole?
5-(3-methylphenyl)-2-piperidin-3-yl-4,5-dihydro-1,3-oxazole has a molecular weight of 244.34 g/mol, XLogP of 2.46, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-methylphenyl)-2-piperidin-3-yl-4,5-dihydro-1,3-oxazole is sourced from PubChem (CID 115061345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).