(5-fluoro-1H-indol-3-yl)-(2-methylfuran-3-yl)methanone

C14H10FNO2 — CID 63850617

IUPAC(5-fluoro-1H-indol-3-yl)-(2-methylfuran-3-yl)methanone
SMILESCc1occc1C(=O)c1c[nH]c2ccc(F)cc12
InChIInChI=1S/C14H10FNO2/c1-8-10(4-5-18-8)14(17)12-7-16-13-3-2-9(15)6-11(12)13/h2-7,16H,1H3
InChIKeyWETITCUIAMGMDZ-UHFFFAOYSA-N
MW243.24 g/mol
LogP3.44
Rot. Bonds2

About (5-fluoro-1H-indol-3-yl)-(2-methylfuran-3-yl)methanone

(5-fluoro-1H-indol-3-yl)-(2-methylfuran-3-yl)methanone (PubChem CID 63850617) has the molecular formula C14H10FNO2 and a molecular weight of 243.24 g/mol. Its IUPAC name is (5-fluoro-1H-indol-3-yl)-(2-methylfuran-3-yl)methanone.

Molecular Properties

Compound Name(5-fluoro-1H-indol-3-yl)-(2-methylfuran-3-yl)methanone
PubChem CID63850617
Molecular FormulaC14H10FNO2
Molecular Weight243.24 g/mol
Exact Mass243.07
IUPAC Name(5-fluoro-1H-indol-3-yl)-(2-methylfuran-3-yl)methanone
SMILESCc1occc1C(=O)c1c[nH]c2ccc(F)cc12
InChIInChI=1S/C14H10FNO2/c1-8-10(4-5-18-8)14(17)12-7-16-13-3-2-9(15)6-11(12)13/h2-7,16H,1H3
InChIKeyWETITCUIAMGMDZ-UHFFFAOYSA-N
XLogP3.44
TPSA46.00 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.24
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2-methylfuran-3-yl)-(5-propan-2-yloxy-1H-indol-3-yl)methanone
CID 80649113
(2,4-difluorophenyl)-(2-methylfuran-3-yl)methanone
CID 43462661
(2-bromo-5-methylphenyl)-(5-fluoro-1H-indol-3-yl)methanone
CID 81109626
(3-amino-5-bromo-2-methylphenyl)-(5-fluoro-1H-indol-3-yl)methanone
CID 107874166
5-fluoro-1H-indole-3-carbonyl iodide
CID 166942307
1-(5-fluoro-1H-indol-3-yl)-2,2-dimethylpropan-1-one
CID 53415729
methyl 5-fluoro-1H-indole-3-carboxylate
CID 34176452
(3-chloro-2-fluorophenyl)-(5-fluoro-1H-indol-3-yl)methanone
CID 81267214
(3-bromo-2-fluorophenyl)-(5-fluoro-1H-indol-3-yl)methanone
CID 107949884
(2,5-dichlorothiophen-3-yl)-(5-fluoro-1H-indol-3-yl)methanone
CID 107960033
2-chloro-1-(5-fluoro-1H-indol-3-yl)ethanone
CID 931809
1-(5-fluoro-1H-indol-3-yl)-3-methylbut-2-en-1-one
CID 53415736

Frequently Asked Questions

What is the IUPAC name of (5-fluoro-1H-indol-3-yl)-(2-methylfuran-3-yl)methanone?
The IUPAC name of (5-fluoro-1H-indol-3-yl)-(2-methylfuran-3-yl)methanone (CID 63850617) is (5-fluoro-1H-indol-3-yl)-(2-methylfuran-3-yl)methanone.
What is the SMILES notation for (5-fluoro-1H-indol-3-yl)-(2-methylfuran-3-yl)methanone?
The canonical SMILES for (5-fluoro-1H-indol-3-yl)-(2-methylfuran-3-yl)methanone is Cc1occc1C(=O)c1c[nH]c2ccc(F)cc12.
What is the InChIKey of (5-fluoro-1H-indol-3-yl)-(2-methylfuran-3-yl)methanone?
The InChIKey is WETITCUIAMGMDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10FNO2/c1-8-10(4-5-18-8)14(17)12-7-16-13-3-2-9(15)6-11(12)13/h2-7,16H,1H3.
What are the key properties of (5-fluoro-1H-indol-3-yl)-(2-methylfuran-3-yl)methanone?
(5-fluoro-1H-indol-3-yl)-(2-methylfuran-3-yl)methanone has a molecular weight of 243.24 g/mol, XLogP of 3.44, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-fluoro-1H-indol-3-yl)-(2-methylfuran-3-yl)methanone is sourced from PubChem (CID 63850617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).