3-phenyl-1,3-oxazolidine

C9H11NO — CID 519787

IUPAC3-phenyl-1,3-oxazolidine
SMILESc1ccc(N2CCOC2)cc1
InChIInChI=1S/C9H11NO/c1-2-4-9(5-3-1)10-6-7-11-8-10/h1-5H,6-8H2
InChIKeyITSRLVMSQHOSEC-UHFFFAOYSA-N
MW149.19 g/mol
LogP1.48
Rot. Bonds1

About 3-phenyl-1,3-oxazolidine

3-phenyl-1,3-oxazolidine (PubChem CID 519787) has the molecular formula C9H11NO and a molecular weight of 149.19 g/mol. Its IUPAC name is 3-phenyl-1,3-oxazolidine.

Molecular Properties

Compound Name3-phenyl-1,3-oxazolidine
PubChem CID519787
Molecular FormulaC9H11NO
Molecular Weight149.19 g/mol
Exact Mass149.08
IUPAC Name3-phenyl-1,3-oxazolidine
SMILESc1ccc(N2CCOC2)cc1
InChIInChI=1S/C9H11NO/c1-2-4-9(5-3-1)10-6-7-11-8-10/h1-5H,6-8H2
InChIKeyITSRLVMSQHOSEC-UHFFFAOYSA-N
XLogP1.48
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.19
LogP ≤ 51.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-(4-bromophenyl)-1,3-oxazolidine
CID 150695273
5-phenyl-1,3,5-dioxazinane
CID 57157399
azanylidyneazanium;4-phenylmorpholine;tetrafluoroborate
CID 88684350
1,1'-biphenyl;ethane;4-phenylmorpholine;toluene
CID 158356993
4,12-diphenyl-1,7,9,15-tetraoxa-4,12-diaza-8-silaspiro[7.7]pentadecane
CID 14118539
4-(4-benzylphenyl)morpholine
CID 11514364
4-morpholin-4-yl-N-phenylaniline
CID 159018746
2-phenyl-1,4,7,10,13,16-hexaoxa-2-azacyclooctadecane
CID 88924597
4-(4-pyrrolidin-1-ylphenyl)morpholine
CID 67305085
4-[4-[2-(4-morpholin-4-ylphenyl)ethenyl]phenyl]morpholine
CID 141350180
4-[3-(1-phenylethenyl)phenyl]morpholine
CID 66742179
3-phenyl-1,3-oxazinan-6-one
CID 22323516

Frequently Asked Questions

What is the IUPAC name of 3-phenyl-1,3-oxazolidine?
The IUPAC name of 3-phenyl-1,3-oxazolidine (CID 519787) is 3-phenyl-1,3-oxazolidine.
What is the SMILES notation for 3-phenyl-1,3-oxazolidine?
The canonical SMILES for 3-phenyl-1,3-oxazolidine is c1ccc(N2CCOC2)cc1.
What is the InChIKey of 3-phenyl-1,3-oxazolidine?
The InChIKey is ITSRLVMSQHOSEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11NO/c1-2-4-9(5-3-1)10-6-7-11-8-10/h1-5H,6-8H2.
What are the key properties of 3-phenyl-1,3-oxazolidine?
3-phenyl-1,3-oxazolidine has a molecular weight of 149.19 g/mol, XLogP of 1.48, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenyl-1,3-oxazolidine is sourced from PubChem (CID 519787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).