morpholin-4-yl-(5-phenyl-2,3-dihydrothiophen-3-yl)methanone

C15H17NO2S — CID 70967146

IUPACmorpholin-4-yl-(5-phenyl-2,3-dihydrothiophen-3-yl)methanone
SMILESO=C(C1C=C(c2ccccc2)SC1)N1CCOCC1
InChIInChI=1S/C15H17NO2S/c17-15(16-6-8-18-9-7-16)13-10-14(19-11-13)12-4-2-1-3-5-12/h1-5,10,13H,6-9,11H2
InChIKeyBDSMGRXYILTPID-UHFFFAOYSA-N
MW275.37 g/mol
LogP2.25
Rot. Bonds2

About morpholin-4-yl-(5-phenyl-2,3-dihydrothiophen-3-yl)methanone

morpholin-4-yl-(5-phenyl-2,3-dihydrothiophen-3-yl)methanone (PubChem CID 70967146) has the molecular formula C15H17NO2S and a molecular weight of 275.37 g/mol. Its IUPAC name is morpholin-4-yl-(5-phenyl-2,3-dihydrothiophen-3-yl)methanone.

Molecular Properties

Compound Namemorpholin-4-yl-(5-phenyl-2,3-dihydrothiophen-3-yl)methanone
PubChem CID70967146
Molecular FormulaC15H17NO2S
Molecular Weight275.37 g/mol
Exact Mass275.10
IUPAC Namemorpholin-4-yl-(5-phenyl-2,3-dihydrothiophen-3-yl)methanone
SMILESO=C(C1C=C(c2ccccc2)SC1)N1CCOCC1
InChIInChI=1S/C15H17NO2S/c17-15(16-6-8-18-9-7-16)13-10-14(19-11-13)12-4-2-1-3-5-12/h1-5,10,13H,6-9,11H2
InChIKeyBDSMGRXYILTPID-UHFFFAOYSA-N
XLogP2.25
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.37
LogP ≤ 52.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of morpholin-4-yl-(5-phenyl-2,3-dihydrothiophen-3-yl)methanone?
The IUPAC name of morpholin-4-yl-(5-phenyl-2,3-dihydrothiophen-3-yl)methanone (CID 70967146) is morpholin-4-yl-(5-phenyl-2,3-dihydrothiophen-3-yl)methanone.
What is the SMILES notation for morpholin-4-yl-(5-phenyl-2,3-dihydrothiophen-3-yl)methanone?
The canonical SMILES for morpholin-4-yl-(5-phenyl-2,3-dihydrothiophen-3-yl)methanone is O=C(C1C=C(c2ccccc2)SC1)N1CCOCC1.
What is the InChIKey of morpholin-4-yl-(5-phenyl-2,3-dihydrothiophen-3-yl)methanone?
The InChIKey is BDSMGRXYILTPID-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO2S/c17-15(16-6-8-18-9-7-16)13-10-14(19-11-13)12-4-2-1-3-5-12/h1-5,10,13H,6-9,11H2.
What are the key properties of morpholin-4-yl-(5-phenyl-2,3-dihydrothiophen-3-yl)methanone?
morpholin-4-yl-(5-phenyl-2,3-dihydrothiophen-3-yl)methanone has a molecular weight of 275.37 g/mol, XLogP of 2.25, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for morpholin-4-yl-(5-phenyl-2,3-dihydrothiophen-3-yl)methanone is sourced from PubChem (CID 70967146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).