ethane;3-ethenyl-1,1-dimethyl-2-[(Z)-prop-1-enyl]indeno[5,4-b][1]benzofuran

C24H26O — CID 142288841

IUPACethane;3-ethenyl-1,1-dimethyl-2-[(Z)-prop-1-enyl]indeno[5,4-b][1]benzofuran
SMILESC=CC1=C(/C=C\C)C(C)(C)c2c1ccc1oc3ccccc3c21.CC
InChIInChI=1S/C22H20O.C2H6/c1-5-9-17-14(6-2)15-12-13-19-20(21(15)22(17,3)4)16-10-7-8-11-18(16)23-19;1-2/h5-13H,2H2,1,3-4H3;1-2H3/b9-5-;
InChIKeyRFJWBDMHETXRIZ-UYTGOYFPSA-N
MW330.47 g/mol
LogP7.42
Rot. Bonds2

About ethane;3-ethenyl-1,1-dimethyl-2-[(Z)-prop-1-enyl]indeno[5,4-b][1]benzofuran

ethane;3-ethenyl-1,1-dimethyl-2-[(Z)-prop-1-enyl]indeno[5,4-b][1]benzofuran (PubChem CID 142288841) has the molecular formula C24H26O and a molecular weight of 330.47 g/mol. Its IUPAC name is ethane;3-ethenyl-1,1-dimethyl-2-[(Z)-prop-1-enyl]indeno[5,4-b][1]benzofuran.

Molecular Properties

Compound Nameethane;3-ethenyl-1,1-dimethyl-2-[(Z)-prop-1-enyl]indeno[5,4-b][1]benzofuran
PubChem CID142288841
Molecular FormulaC24H26O
Molecular Weight330.47 g/mol
Exact Mass330.20
IUPAC Nameethane;3-ethenyl-1,1-dimethyl-2-[(Z)-prop-1-enyl]indeno[5,4-b][1]benzofuran
SMILESC=CC1=C(/C=C\C)C(C)(C)c2c1ccc1oc3ccccc3c21.CC
InChIInChI=1S/C22H20O.C2H6/c1-5-9-17-14(6-2)15-12-13-19-20(21(15)22(17,3)4)16-10-7-8-11-18(16)23-19;1-2/h5-13H,2H2,1,3-4H3;1-2H3/b9-5-;
InChIKeyRFJWBDMHETXRIZ-UYTGOYFPSA-N
XLogP7.42
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500330.47
LogP ≤ 57.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-dibenzofuran-2-yl-4-[8-[3-[1'-ethenyl-2'-[(Z)-prop-1-enyl]spiro[fluorene-9,3'-indene]-4'-yl]phenyl]dibenzofuran-1-yl]-6-phenyl-1,3,5-triazine
CID 156734639
N-(4-dibenzofuran-4-ylphenyl)-N-[3-ethenyl-1,1-dimethyl-2-[(Z)-prop-1-enyl]inden-4-yl]-9,9'-spirobi[fluorene]-2-amine
CID 167119017
1-[2',3'-bis(ethenyl)spiro[fluorene-9,1'-indene]-2-yl]dibenzofuran
CID 142417716
2-(12,12-dimethylfluoreno[2,1-b][1]benzofuran-10-yl)-4,6-diphenylpyrimidine
CID 154602693
5-[2-ethenyl-1-[(Z)-prop-1-enyl]-[1]benzofuro[3,2-e][1]benzofuran-9-yl]-9,14-dioxapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene
CID 167256599
5-N,21-N-di(dibenzofuran-2-yl)-21-N-[3'-ethenyl-2'-[(Z)-prop-1-enyl]spiro[fluorene-9,1'-indene]-2-yl]-5-N-(9,9'-spirobi[fluorene]-2-yl)-23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2(7),3,5,8,10,12,14,16(24),17(22),18,20-dodecaene-5,21-diamine
CID 146494540
N-[1-ethenyl-3,3-dimethyl-2-[(Z)-prop-1-enyl]inden-5-yl]-9,9-dimethylfluoren-2-amine
CID 129111188
3,3'-bis(ethenyl)-2,2'-bis[(Z)-prop-1-enyl]-1,1'-spirobi[indene]
CID 145204058
3-methyl-2-[(Z)-prop-1-enyl]-1H-[1]benzofuro[2,3-g]indole
CID 167453493
dibenzofuran-1,2-diamine
CID 21425844
2-[2',3'-bis(ethenyl)spiro[fluorene-9,1'-indene]-2-yl]dibenzofuran
CID 142417659
1-(9,9-dimethylfluoren-2-yl)dibenzofuran
CID 135131462

Frequently Asked Questions

What is the IUPAC name of ethane;3-ethenyl-1,1-dimethyl-2-[(Z)-prop-1-enyl]indeno[5,4-b][1]benzofuran?
The IUPAC name of ethane;3-ethenyl-1,1-dimethyl-2-[(Z)-prop-1-enyl]indeno[5,4-b][1]benzofuran (CID 142288841) is ethane;3-ethenyl-1,1-dimethyl-2-[(Z)-prop-1-enyl]indeno[5,4-b][1]benzofuran.
What is the SMILES notation for ethane;3-ethenyl-1,1-dimethyl-2-[(Z)-prop-1-enyl]indeno[5,4-b][1]benzofuran?
The canonical SMILES for ethane;3-ethenyl-1,1-dimethyl-2-[(Z)-prop-1-enyl]indeno[5,4-b][1]benzofuran is C=CC1=C(/C=C\C)C(C)(C)c2c1ccc1oc3ccccc3c21.CC.
What is the InChIKey of ethane;3-ethenyl-1,1-dimethyl-2-[(Z)-prop-1-enyl]indeno[5,4-b][1]benzofuran?
The InChIKey is RFJWBDMHETXRIZ-UYTGOYFPSA-N. The full InChI is InChI=1S/C22H20O.C2H6/c1-5-9-17-14(6-2)15-12-13-19-20(21(15)22(17,3)4)16-10-7-8-11-18(16)23-19;1-2/h5-13H,2H2,1,3-4H3;1-2H3/b9-5-;.
What are the key properties of ethane;3-ethenyl-1,1-dimethyl-2-[(Z)-prop-1-enyl]indeno[5,4-b][1]benzofuran?
ethane;3-ethenyl-1,1-dimethyl-2-[(Z)-prop-1-enyl]indeno[5,4-b][1]benzofuran has a molecular weight of 330.47 g/mol, XLogP of 7.42, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;3-ethenyl-1,1-dimethyl-2-[(Z)-prop-1-enyl]indeno[5,4-b][1]benzofuran is sourced from PubChem (CID 142288841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).