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

C17H12N2O2 — CID 5330535

IUPAC(5-hydroxy-1H-indol-2-yl)-(1H-indol-2-yl)methanone
SMILESO=C(c1cc2ccccc2[nH]1)c1cc2cc(O)ccc2[nH]1
InChIInChI=1S/C17H12N2O2/c20-12-5-6-14-11(7-12)9-16(19-14)17(21)15-8-10-3-1-2-4-13(10)18-15/h1-9,18-20H
InChIKeyAALNCHNFTKRFEL-UHFFFAOYSA-N
MW276.30 g/mol
LogP3.59
Rot. Bonds2

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

(5-hydroxy-1H-indol-2-yl)-(1H-indol-2-yl)methanone (PubChem CID 5330535) has the molecular formula C17H12N2O2 and a molecular weight of 276.30 g/mol. Its IUPAC name is (5-hydroxy-1H-indol-2-yl)-(1H-indol-2-yl)methanone.

Molecular Properties

Compound Name(5-hydroxy-1H-indol-2-yl)-(1H-indol-2-yl)methanone
PubChem CID5330535
Molecular FormulaC17H12N2O2
Molecular Weight276.30 g/mol
Exact Mass276.09
IUPAC Name(5-hydroxy-1H-indol-2-yl)-(1H-indol-2-yl)methanone
SMILESO=C(c1cc2ccccc2[nH]1)c1cc2cc(O)ccc2[nH]1
InChIInChI=1S/C17H12N2O2/c20-12-5-6-14-11(7-12)9-16(19-14)17(21)15-8-10-3-1-2-4-13(10)18-15/h1-9,18-20H
InChIKeyAALNCHNFTKRFEL-UHFFFAOYSA-N
XLogP3.59
TPSA68.88 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.30
LogP ≤ 53.59
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
5-Methoxyindole-2-carboxylic acid
CID 20401
Violacein
CID 11053
9-Hydroxy-4-phenylpyrrolo[3,4-C]carbazole-1,3(2H,6H)-dione
CID 4369491
5-(phenylmethoxy)-1H-indole-2-carboxylic acid
CID 81146
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
Bis(1H-2-indolyl)methanone 45
CID 5330541
Bis(1H-2-indolyl)methanone deriv. 49
CID 5330545
Bis(1H-2-indolyl)methanone deriv. 50
CID 5330546

Frequently Asked Questions

What is the IUPAC name of (5-hydroxy-1H-indol-2-yl)-(1H-indol-2-yl)methanone?
The IUPAC name of (5-hydroxy-1H-indol-2-yl)-(1H-indol-2-yl)methanone (CID 5330535) is (5-hydroxy-1H-indol-2-yl)-(1H-indol-2-yl)methanone.
What is the SMILES notation for (5-hydroxy-1H-indol-2-yl)-(1H-indol-2-yl)methanone?
The canonical SMILES for (5-hydroxy-1H-indol-2-yl)-(1H-indol-2-yl)methanone is O=C(c1cc2ccccc2[nH]1)c1cc2cc(O)ccc2[nH]1.
What is the InChIKey of (5-hydroxy-1H-indol-2-yl)-(1H-indol-2-yl)methanone?
The InChIKey is AALNCHNFTKRFEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12N2O2/c20-12-5-6-14-11(7-12)9-16(19-14)17(21)15-8-10-3-1-2-4-13(10)18-15/h1-9,18-20H.
What are the key properties of (5-hydroxy-1H-indol-2-yl)-(1H-indol-2-yl)methanone?
(5-hydroxy-1H-indol-2-yl)-(1H-indol-2-yl)methanone has a molecular weight of 276.30 g/mol, XLogP of 3.59, 2 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-hydroxy-1H-indol-2-yl)-(1H-indol-2-yl)methanone is sourced from PubChem (CID 5330535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).