morpholin-4-yl-[5-[(E)-2-phenylethenyl]furan-2-yl]methanone

C17H17NO3 — CID 119068386

IUPACmorpholin-4-yl-[5-[(E)-2-phenylethenyl]furan-2-yl]methanone
SMILESO=C(c1ccc(/C=C/c2ccccc2)o1)N1CCOCC1
InChIInChI=1S/C17H17NO3/c19-17(18-10-12-20-13-11-18)16-9-8-15(21-16)7-6-14-4-2-1-3-5-14/h1-9H,10-13H2/b7-6+
InChIKeyZXBNXXAELGVKPB-VOTSOKGWSA-N
MW283.33 g/mol
LogP2.92
Rot. Bonds3

About morpholin-4-yl-[5-[(E)-2-phenylethenyl]furan-2-yl]methanone

morpholin-4-yl-[5-[(E)-2-phenylethenyl]furan-2-yl]methanone (PubChem CID 119068386) has the molecular formula C17H17NO3 and a molecular weight of 283.33 g/mol. Its IUPAC name is morpholin-4-yl-[5-[(E)-2-phenylethenyl]furan-2-yl]methanone.

Molecular Properties

Compound Namemorpholin-4-yl-[5-[(E)-2-phenylethenyl]furan-2-yl]methanone
PubChem CID119068386
Molecular FormulaC17H17NO3
Molecular Weight283.33 g/mol
Exact Mass283.12
IUPAC Namemorpholin-4-yl-[5-[(E)-2-phenylethenyl]furan-2-yl]methanone
SMILESO=C(c1ccc(/C=C/c2ccccc2)o1)N1CCOCC1
InChIInChI=1S/C17H17NO3/c19-17(18-10-12-20-13-11-18)16-9-8-15(21-16)7-6-14-4-2-1-3-5-14/h1-9H,10-13H2/b7-6+
InChIKeyZXBNXXAELGVKPB-VOTSOKGWSA-N
XLogP2.92
TPSA42.68 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 52.92
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-[(E)-2-phenylethenyl]furan-2-yl]methanone?
The IUPAC name of morpholin-4-yl-[5-[(E)-2-phenylethenyl]furan-2-yl]methanone (CID 119068386) is morpholin-4-yl-[5-[(E)-2-phenylethenyl]furan-2-yl]methanone.
What is the SMILES notation for morpholin-4-yl-[5-[(E)-2-phenylethenyl]furan-2-yl]methanone?
The canonical SMILES for morpholin-4-yl-[5-[(E)-2-phenylethenyl]furan-2-yl]methanone is O=C(c1ccc(/C=C/c2ccccc2)o1)N1CCOCC1.
What is the InChIKey of morpholin-4-yl-[5-[(E)-2-phenylethenyl]furan-2-yl]methanone?
The InChIKey is ZXBNXXAELGVKPB-VOTSOKGWSA-N. The full InChI is InChI=1S/C17H17NO3/c19-17(18-10-12-20-13-11-18)16-9-8-15(21-16)7-6-14-4-2-1-3-5-14/h1-9H,10-13H2/b7-6+.
What are the key properties of morpholin-4-yl-[5-[(E)-2-phenylethenyl]furan-2-yl]methanone?
morpholin-4-yl-[5-[(E)-2-phenylethenyl]furan-2-yl]methanone has a molecular weight of 283.33 g/mol, XLogP of 2.92, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for morpholin-4-yl-[5-[(E)-2-phenylethenyl]furan-2-yl]methanone is sourced from PubChem (CID 119068386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).