(6-fluoro-2,3-dihydroindol-1-yl)-(1H-indol-4-yl)methanone

C17H13FN2O — CID 103720917

IUPAC(6-fluoro-2,3-dihydroindol-1-yl)-(1H-indol-4-yl)methanone
SMILESO=C(c1cccc2[nH]ccc12)N1CCc2ccc(F)cc21
InChIInChI=1S/C17H13FN2O/c18-12-5-4-11-7-9-20(16(11)10-12)17(21)14-2-1-3-15-13(14)6-8-19-15/h1-6,8,10,19H,7,9H2
InChIKeyWYYBDLOWIJWUPP-UHFFFAOYSA-N
MW280.30 g/mol
LogP3.51
Rot. Bonds1

About (6-fluoro-2,3-dihydroindol-1-yl)-(1H-indol-4-yl)methanone

(6-fluoro-2,3-dihydroindol-1-yl)-(1H-indol-4-yl)methanone (PubChem CID 103720917) has the molecular formula C17H13FN2O and a molecular weight of 280.30 g/mol. Its IUPAC name is (6-fluoro-2,3-dihydroindol-1-yl)-(1H-indol-4-yl)methanone.

Molecular Properties

Compound Name(6-fluoro-2,3-dihydroindol-1-yl)-(1H-indol-4-yl)methanone
PubChem CID103720917
Molecular FormulaC17H13FN2O
Molecular Weight280.30 g/mol
Exact Mass280.10
IUPAC Name(6-fluoro-2,3-dihydroindol-1-yl)-(1H-indol-4-yl)methanone
SMILESO=C(c1cccc2[nH]ccc12)N1CCc2ccc(F)cc21
InChIInChI=1S/C17H13FN2O/c18-12-5-4-11-7-9-20(16(11)10-12)17(21)14-2-1-3-15-13(14)6-8-19-15/h1-6,8,10,19H,7,9H2
InChIKeyWYYBDLOWIJWUPP-UHFFFAOYSA-N
XLogP3.51
TPSA36.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.30
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3,4-dihydro-2H-quinolin-1-yl(1H-indol-4-yl)methanone
CID 43582707
(2,4-diaminophenyl)-(6-fluoro-2,3-dihydroindol-1-yl)methanone
CID 103493819
azepan-1-yl(1H-indol-4-yl)methanone
CID 43582350
(2-chloro-5-sulfanylphenyl)-(6-fluoro-2,3-dihydroindol-1-yl)methanone
CID 107037112
(4-chloro-3-pyridinyl)-(6-fluoro-2,3-dihydroindol-1-yl)methanone
CID 103872831
(3-amino-4-pyridinyl)-(6-fluoro-2,3-dihydroindol-1-yl)methanone
CID 103502191
(3-chloro-4-pyridinyl)-(6-fluoro-2,3-dihydroindol-1-yl)methanone
CID 103714816
2,3-dihydro-1H-indol-6-yl-(6-fluoro-2,3-dihydroindol-1-yl)methanone
CID 103495318
(5-bromothiophen-2-yl)-(6-fluoro-2,3-dihydroindol-1-yl)methanone
CID 113228439
(5-bromofuran-2-yl)-(6-fluoro-2,3-dihydroindol-1-yl)methanone
CID 113228436
(4-amino-2-pyridinyl)-(6-fluoro-2,3-dihydroindol-1-yl)methanone
CID 103502157
2-amino-1-(6-fluoro-2,3-dihydroindol-1-yl)ethanone
CID 103796139

Frequently Asked Questions

What is the IUPAC name of (6-fluoro-2,3-dihydroindol-1-yl)-(1H-indol-4-yl)methanone?
The IUPAC name of (6-fluoro-2,3-dihydroindol-1-yl)-(1H-indol-4-yl)methanone (CID 103720917) is (6-fluoro-2,3-dihydroindol-1-yl)-(1H-indol-4-yl)methanone.
What is the SMILES notation for (6-fluoro-2,3-dihydroindol-1-yl)-(1H-indol-4-yl)methanone?
The canonical SMILES for (6-fluoro-2,3-dihydroindol-1-yl)-(1H-indol-4-yl)methanone is O=C(c1cccc2[nH]ccc12)N1CCc2ccc(F)cc21.
What is the InChIKey of (6-fluoro-2,3-dihydroindol-1-yl)-(1H-indol-4-yl)methanone?
The InChIKey is WYYBDLOWIJWUPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13FN2O/c18-12-5-4-11-7-9-20(16(11)10-12)17(21)14-2-1-3-15-13(14)6-8-19-15/h1-6,8,10,19H,7,9H2.
What are the key properties of (6-fluoro-2,3-dihydroindol-1-yl)-(1H-indol-4-yl)methanone?
(6-fluoro-2,3-dihydroindol-1-yl)-(1H-indol-4-yl)methanone has a molecular weight of 280.30 g/mol, XLogP of 3.51, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (6-fluoro-2,3-dihydroindol-1-yl)-(1H-indol-4-yl)methanone is sourced from PubChem (CID 103720917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).