2-[(3Z)-3-ethylidene-2-methylidene-1-benzofuran-5-yl]dibenzofuran

C23H16O2 — CID 144553605

IUPAC2-[(3Z)-3-ethylidene-2-methylidene-1-benzofuran-5-yl]dibenzofuran
SMILESC=c1oc2ccc(-c3ccc4oc5ccccc5c4c3)cc2/c1=C/C
InChIInChI=1S/C23H16O2/c1-3-17-14(2)24-22-10-8-15(12-19(17)22)16-9-11-23-20(13-16)18-6-4-5-7-21(18)25-23/h3-13H,2H2,1H3/b17-3+
InChIKeyUFGHFBLTWOPEBU-IJUHEHPCSA-N
MW324.38 g/mol
LogP5.21
Rot. Bonds1

About 2-[(3Z)-3-ethylidene-2-methylidene-1-benzofuran-5-yl]dibenzofuran

2-[(3Z)-3-ethylidene-2-methylidene-1-benzofuran-5-yl]dibenzofuran (PubChem CID 144553605) has the molecular formula C23H16O2 and a molecular weight of 324.38 g/mol. Its IUPAC name is 2-[(3Z)-3-ethylidene-2-methylidene-1-benzofuran-5-yl]dibenzofuran.

Molecular Properties

Compound Name2-[(3Z)-3-ethylidene-2-methylidene-1-benzofuran-5-yl]dibenzofuran
PubChem CID144553605
Molecular FormulaC23H16O2
Molecular Weight324.38 g/mol
Exact Mass324.12
IUPAC Name2-[(3Z)-3-ethylidene-2-methylidene-1-benzofuran-5-yl]dibenzofuran
SMILESC=c1oc2ccc(-c3ccc4oc5ccccc5c4c3)cc2/c1=C/C
InChIInChI=1S/C23H16O2/c1-3-17-14(2)24-22-10-8-15(12-19(17)22)16-9-11-23-20(13-16)18-6-4-5-7-21(18)25-23/h3-13H,2H2,1H3/b17-3+
InChIKeyUFGHFBLTWOPEBU-IJUHEHPCSA-N
XLogP5.21
TPSA26.28 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500324.38
LogP ≤ 55.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-[2,6,10-tri(dibenzofuran-2-yl)anthracen-9-yl]dibenzofuran
CID 143933892
2-[3-dibenzofuran-2-yl-5-[7-[3,5-di(dibenzofuran-2-yl)phenyl]triphenylen-2-yl]phenyl]dibenzofuran
CID 118490746
2-[4-(4-methylnaphthalen-1-yl)phenyl]dibenzofuran
CID 67964760
2-[3-[(3E)-penta-1,3-dien-3-yl]phenyl]dibenzofuran
CID 144925010
2-(10-dibenzofuran-3-ylanthracen-9-yl)dibenzofuran
CID 135208637
CID 90291993
CID 90291993
2-[10-[4-(4-phenylphenyl)phenyl]anthracen-9-yl]dibenzofuran
CID 135208803
2-dibenzofuran-2-yl-8-dibenzofuran-2-yloxydibenzofuran
CID 90250402
N,N-bis(4-dibenzofuran-2-ylphenyl)-4-[4-(4-dibenzofuran-2-ylphenyl)phenyl]aniline
CID 58510590
6-[8-(3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14,16,18-nonaen-7-yl)dibenzofuran-2-yl]-10,20-dioxapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1,3(11),4(9),5,7,12,14,16,18-nonaene
CID 142487676
3-dibenzofuran-2-yl-9-methylcarbazole
CID 121307339
6-[3-(3-triphenylen-2-ylphenyl)phenyl]-10,20-dioxapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1,3(11),4(9),5,7,12,14,16,18-nonaene
CID 163594432

Frequently Asked Questions

What is the IUPAC name of 2-[(3Z)-3-ethylidene-2-methylidene-1-benzofuran-5-yl]dibenzofuran?
The IUPAC name of 2-[(3Z)-3-ethylidene-2-methylidene-1-benzofuran-5-yl]dibenzofuran (CID 144553605) is 2-[(3Z)-3-ethylidene-2-methylidene-1-benzofuran-5-yl]dibenzofuran.
What is the SMILES notation for 2-[(3Z)-3-ethylidene-2-methylidene-1-benzofuran-5-yl]dibenzofuran?
The canonical SMILES for 2-[(3Z)-3-ethylidene-2-methylidene-1-benzofuran-5-yl]dibenzofuran is C=c1oc2ccc(-c3ccc4oc5ccccc5c4c3)cc2/c1=C/C.
What is the InChIKey of 2-[(3Z)-3-ethylidene-2-methylidene-1-benzofuran-5-yl]dibenzofuran?
The InChIKey is UFGHFBLTWOPEBU-IJUHEHPCSA-N. The full InChI is InChI=1S/C23H16O2/c1-3-17-14(2)24-22-10-8-15(12-19(17)22)16-9-11-23-20(13-16)18-6-4-5-7-21(18)25-23/h3-13H,2H2,1H3/b17-3+.
What are the key properties of 2-[(3Z)-3-ethylidene-2-methylidene-1-benzofuran-5-yl]dibenzofuran?
2-[(3Z)-3-ethylidene-2-methylidene-1-benzofuran-5-yl]dibenzofuran has a molecular weight of 324.38 g/mol, XLogP of 5.21, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3Z)-3-ethylidene-2-methylidene-1-benzofuran-5-yl]dibenzofuran is sourced from PubChem (CID 144553605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).