(4-ethoxy-1H-indol-3-yl)-(furan-3-yl)methanone

C15H13NO3 — CID 83163327

IUPAC(4-ethoxy-1H-indol-3-yl)-(furan-3-yl)methanone
SMILESCCOc1cccc2[nH]cc(C(=O)c3ccoc3)c12
InChIInChI=1S/C15H13NO3/c1-2-19-13-5-3-4-12-14(13)11(8-16-12)15(17)10-6-7-18-9-10/h3-9,16H,2H2,1H3
InChIKeyWZOBGCRTWYTMKY-UHFFFAOYSA-N
MW255.27 g/mol
LogP3.39
Rot. Bonds4

About (4-ethoxy-1H-indol-3-yl)-(furan-3-yl)methanone

(4-ethoxy-1H-indol-3-yl)-(furan-3-yl)methanone (PubChem CID 83163327) has the molecular formula C15H13NO3 and a molecular weight of 255.27 g/mol. Its IUPAC name is (4-ethoxy-1H-indol-3-yl)-(furan-3-yl)methanone.

Molecular Properties

Compound Name(4-ethoxy-1H-indol-3-yl)-(furan-3-yl)methanone
PubChem CID83163327
Molecular FormulaC15H13NO3
Molecular Weight255.27 g/mol
Exact Mass255.09
IUPAC Name(4-ethoxy-1H-indol-3-yl)-(furan-3-yl)methanone
SMILESCCOc1cccc2[nH]cc(C(=O)c3ccoc3)c12
InChIInChI=1S/C15H13NO3/c1-2-19-13-5-3-4-12-14(13)11(8-16-12)15(17)10-6-7-18-9-10/h3-9,16H,2H2,1H3
InChIKeyWZOBGCRTWYTMKY-UHFFFAOYSA-N
XLogP3.39
TPSA55.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.27
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

furan-3-yl-(4-propoxy-1H-indol-3-yl)methanone
CID 83163488
2-chloro-1-(4-ethoxy-1H-indol-3-yl)ethanone
CID 83162554
2-chloro-1-(4-ethoxy-1H-indol-3-yl)propan-1-one
CID 83162396
(4-ethoxy-1H-indol-3-yl)-(3-methylthiophen-2-yl)methanone
CID 83163405
1-(4-ethoxy-1H-indol-3-yl)-3-methylbutan-1-one
CID 83162797
(3-bromothiophen-2-yl)-(4-ethoxy-1H-indol-3-yl)methanone
CID 83162872
(2-ethoxyphenyl)-(4-methyl-1H-indol-3-yl)methanone
CID 43341913
(4,5-dibromothiophen-2-yl)-(4-ethoxy-1H-indol-3-yl)methanone
CID 83164049
2-(4-ethoxy-1H-indol-3-yl)acetic acid
CID 45094545
cyclohexyl-(4-ethoxy-1H-indol-3-yl)methanone
CID 83162479
(4-ethoxy-1H-indol-3-yl)-(1-ethylcyclopentyl)methanone
CID 83164060
4-ethoxy-3-ethyl-1H-indole
CID 171816854

Frequently Asked Questions

What is the IUPAC name of (4-ethoxy-1H-indol-3-yl)-(furan-3-yl)methanone?
The IUPAC name of (4-ethoxy-1H-indol-3-yl)-(furan-3-yl)methanone (CID 83163327) is (4-ethoxy-1H-indol-3-yl)-(furan-3-yl)methanone.
What is the SMILES notation for (4-ethoxy-1H-indol-3-yl)-(furan-3-yl)methanone?
The canonical SMILES for (4-ethoxy-1H-indol-3-yl)-(furan-3-yl)methanone is CCOc1cccc2[nH]cc(C(=O)c3ccoc3)c12.
What is the InChIKey of (4-ethoxy-1H-indol-3-yl)-(furan-3-yl)methanone?
The InChIKey is WZOBGCRTWYTMKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13NO3/c1-2-19-13-5-3-4-12-14(13)11(8-16-12)15(17)10-6-7-18-9-10/h3-9,16H,2H2,1H3.
What are the key properties of (4-ethoxy-1H-indol-3-yl)-(furan-3-yl)methanone?
(4-ethoxy-1H-indol-3-yl)-(furan-3-yl)methanone has a molecular weight of 255.27 g/mol, XLogP of 3.39, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-ethoxy-1H-indol-3-yl)-(furan-3-yl)methanone is sourced from PubChem (CID 83163327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).