1-ethyl-2-methylidene-1H-benzo[e][1]benzofuran

C15H14O — CID 132583813

IUPAC1-ethyl-2-methylidene-1H-benzo[e][1]benzofuran
SMILESC=C1Oc2ccc3ccccc3c2C1CC
InChIInChI=1S/C15H14O/c1-3-12-10(2)16-14-9-8-11-6-4-5-7-13(11)15(12)14/h4-9,12H,2-3H2,1H3
InChIKeyAEUPHAOOUQCSGG-UHFFFAOYSA-N
MW210.28 g/mol
LogP4.24
Rot. Bonds1

About 1-ethyl-2-methylidene-1H-benzo[e][1]benzofuran

1-ethyl-2-methylidene-1H-benzo[e][1]benzofuran (PubChem CID 132583813) has the molecular formula C15H14O and a molecular weight of 210.28 g/mol. Its IUPAC name is 1-ethyl-2-methylidene-1H-benzo[e][1]benzofuran.

Molecular Properties

Compound Name1-ethyl-2-methylidene-1H-benzo[e][1]benzofuran
PubChem CID132583813
Molecular FormulaC15H14O
Molecular Weight210.28 g/mol
Exact Mass210.10
IUPAC Name1-ethyl-2-methylidene-1H-benzo[e][1]benzofuran
SMILESC=C1Oc2ccc3ccccc3c2C1CC
InChIInChI=1S/C15H14O/c1-3-12-10(2)16-14-9-8-11-6-4-5-7-13(11)15(12)14/h4-9,12H,2-3H2,1H3
InChIKeyAEUPHAOOUQCSGG-UHFFFAOYSA-N
XLogP4.24
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 54.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2-chlorophenyl)-2-methylidene-1H-benzo[e][1]benzofuran
CID 132583807
2-methylidene-1-[4-(trifluoromethyl)phenyl]-1H-benzo[e][1]benzofuran
CID 132583802
2-methylidene-1-propan-2-yl-1H-benzo[f]chromen-3-one
CID 70690575
(1S)-1-[(1R)-3-oxo-1,2-dihydrobenzo[f][1,3]benzoxazin-1-yl]-1,2-dihydrobenzo[f][1,3]benzoxazin-3-one
CID 102487535
9,9-dimethyl-12-propyl-10,12-dihydro-8H-benzo[a]xanthen-11-one
CID 138976712
2-(4-dodecylphenyl)-13-oxapentacyclo[12.8.0.03,12.04,9.017,22]docosa-1(14),3(12),4,6,8,10,15,17,19,21-decaene
CID 102173164
2-(4-phenanthren-9-ylphenyl)-13-oxapentacyclo[12.8.0.03,12.04,9.017,22]docosa-1(14),3(12),4,6,8,10,15,17,19,21-decaene
CID 146578169
(1R,2S,16S,21S)-13,24-dioxa-15,22-diazaoctacyclo[20.12.0.02,15.03,12.04,9.016,21.025,34.028,33]tetratriaconta-3(12),4,6,8,10,25(34),26,28,30,32-decaene-14,23-dione
CID 132545903
2-[4-(10-phenylanthracen-9-yl)phenyl]-13-oxapentacyclo[12.8.0.03,12.04,9.017,22]docosa-1(14),3(12),4,6,8,10,15,17,19,21-decaene
CID 146578133
2-(5-methylfuran-2-yl)-13-oxapentacyclo[12.8.0.03,12.04,9.017,22]docosa-1(14),3(12),4(9),5,7,10,15,17,19,21-decaen-6-ol
CID 135216197
2-methyl-13-oxa-2-azapentacyclo[12.8.0.03,12.04,9.017,22]docosa-1(14),3(12),4,6,8,10,15,17,19,21-decaene
CID 58185057
4-(12H-benzo[a]xanthen-12-yl)-N,N-dimethylaniline
CID 45258388

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-2-methylidene-1H-benzo[e][1]benzofuran?
The IUPAC name of 1-ethyl-2-methylidene-1H-benzo[e][1]benzofuran (CID 132583813) is 1-ethyl-2-methylidene-1H-benzo[e][1]benzofuran.
What is the SMILES notation for 1-ethyl-2-methylidene-1H-benzo[e][1]benzofuran?
The canonical SMILES for 1-ethyl-2-methylidene-1H-benzo[e][1]benzofuran is C=C1Oc2ccc3ccccc3c2C1CC.
What is the InChIKey of 1-ethyl-2-methylidene-1H-benzo[e][1]benzofuran?
The InChIKey is AEUPHAOOUQCSGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14O/c1-3-12-10(2)16-14-9-8-11-6-4-5-7-13(11)15(12)14/h4-9,12H,2-3H2,1H3.
What are the key properties of 1-ethyl-2-methylidene-1H-benzo[e][1]benzofuran?
1-ethyl-2-methylidene-1H-benzo[e][1]benzofuran has a molecular weight of 210.28 g/mol, XLogP of 4.24, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-2-methylidene-1H-benzo[e][1]benzofuran is sourced from PubChem (CID 132583813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).