(5-fluoro-1H-indol-2-yl)-(5-hydroxy-1H-indol-2-yl)methanone

C17H11FN2O2 — CID 11652264

IUPAC(5-fluoro-1H-indol-2-yl)-(5-hydroxy-1H-indol-2-yl)methanone
SMILESO=C(c1cc2cc(O)ccc2[nH]1)c1cc2cc(F)ccc2[nH]1
InChIInChI=1S/C17H11FN2O2/c18-11-1-3-13-9(5-11)7-15(19-13)17(22)16-8-10-6-12(21)2-4-14(10)20-16/h1-8,19-21H
InChIKeySAQMSZICCVWJSF-UHFFFAOYSA-N
MW294.29 g/mol
LogP3.72
Rot. Bonds2

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

(5-fluoro-1H-indol-2-yl)-(5-hydroxy-1H-indol-2-yl)methanone (PubChem CID 11652264) has the molecular formula C17H11FN2O2 and a molecular weight of 294.29 g/mol. Its IUPAC name is (5-fluoro-1H-indol-2-yl)-(5-hydroxy-1H-indol-2-yl)methanone.

Molecular Properties

Compound Name(5-fluoro-1H-indol-2-yl)-(5-hydroxy-1H-indol-2-yl)methanone
PubChem CID11652264
Molecular FormulaC17H11FN2O2
Molecular Weight294.29 g/mol
Exact Mass294.08
IUPAC Name(5-fluoro-1H-indol-2-yl)-(5-hydroxy-1H-indol-2-yl)methanone
SMILESO=C(c1cc2cc(O)ccc2[nH]1)c1cc2cc(F)ccc2[nH]1
InChIInChI=1S/C17H11FN2O2/c18-11-1-3-13-9(5-11)7-15(19-13)17(22)16-8-10-6-12(21)2-4-14(10)20-16/h1-8,19-21H
InChIKeySAQMSZICCVWJSF-UHFFFAOYSA-N
XLogP3.72
TPSA68.88 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.29
LogP ≤ 53.72
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

2H-Indol-2-one, 3-(1,3-dihydro-3-oxo-2H-indol-2-ylidene)-1,3-dihydro-
CID 10177
Violacein
CID 11053
9-Hydroxy-4-phenylpyrrolo[3,4-C]carbazole-1,3(2H,6H)-dione
CID 4369491
5-Hydroxyindole-2-carboxylic acid
CID 88958
D-64131
CID 3921152
Bis(1H-2-indolyl)methanone 11
CID 5330527
Bis(1H-2-indolyl)methanone 12
CID 5330528
(5-hydroxy-1H-indol-2-yl)(1H-indol-2-yl)methanone
CID 5330535
Bis(1H-2-indolyl)methanone 45
CID 5330541
Bis(1H-2-indolyl)methanone deriv. 50
CID 5330546
Bis(1H-2-indolyl)methanone deriv. 54
CID 5330549
Bis(1H-2-indolyl)methanone deriv. 60
CID 5330555

Frequently Asked Questions

What is the IUPAC name of (5-fluoro-1H-indol-2-yl)-(5-hydroxy-1H-indol-2-yl)methanone?
The IUPAC name of (5-fluoro-1H-indol-2-yl)-(5-hydroxy-1H-indol-2-yl)methanone (CID 11652264) is (5-fluoro-1H-indol-2-yl)-(5-hydroxy-1H-indol-2-yl)methanone.
What is the SMILES notation for (5-fluoro-1H-indol-2-yl)-(5-hydroxy-1H-indol-2-yl)methanone?
The canonical SMILES for (5-fluoro-1H-indol-2-yl)-(5-hydroxy-1H-indol-2-yl)methanone is O=C(c1cc2cc(O)ccc2[nH]1)c1cc2cc(F)ccc2[nH]1.
What is the InChIKey of (5-fluoro-1H-indol-2-yl)-(5-hydroxy-1H-indol-2-yl)methanone?
The InChIKey is SAQMSZICCVWJSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11FN2O2/c18-11-1-3-13-9(5-11)7-15(19-13)17(22)16-8-10-6-12(21)2-4-14(10)20-16/h1-8,19-21H.
What are the key properties of (5-fluoro-1H-indol-2-yl)-(5-hydroxy-1H-indol-2-yl)methanone?
(5-fluoro-1H-indol-2-yl)-(5-hydroxy-1H-indol-2-yl)methanone has a molecular weight of 294.29 g/mol, XLogP of 3.72, 2 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-fluoro-1H-indol-2-yl)-(5-hydroxy-1H-indol-2-yl)methanone is sourced from PubChem (CID 11652264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).