2-hydroxy-1-(1H-indol-3-yl)-9H-carbazole-3-carboxylic acid

C21H14N2O3 — CID 10291090

IUPAC2-hydroxy-1-(1H-indol-3-yl)-9H-carbazole-3-carboxylic acid
SMILESO=C(O)c1cc2c([nH]c3ccccc32)c(-c2c[nH]c3ccccc23)c1O
InChIInChI=1S/C21H14N2O3/c24-20-14(21(25)26)9-13-11-5-2-4-8-17(11)23-19(13)18(20)15-10-22-16-7-3-1-6-12(15)16/h1-10,22-24H,(H,25,26)
InChIKeyUPORVYGDZIGCGB-UHFFFAOYSA-N
MW342.35 g/mol
LogP4.87
Rot. Bonds2

About 2-hydroxy-1-(1H-indol-3-yl)-9H-carbazole-3-carboxylic acid

2-hydroxy-1-(1H-indol-3-yl)-9H-carbazole-3-carboxylic acid (PubChem CID 10291090) has the molecular formula C21H14N2O3 and a molecular weight of 342.35 g/mol. Its IUPAC name is 2-hydroxy-1-(1H-indol-3-yl)-9H-carbazole-3-carboxylic acid.

Molecular Properties

Compound Name2-hydroxy-1-(1H-indol-3-yl)-9H-carbazole-3-carboxylic acid
PubChem CID10291090
Molecular FormulaC21H14N2O3
Molecular Weight342.35 g/mol
Exact Mass342.10
IUPAC Name2-hydroxy-1-(1H-indol-3-yl)-9H-carbazole-3-carboxylic acid
SMILESO=C(O)c1cc2c([nH]c3ccccc32)c(-c2c[nH]c3ccccc23)c1O
InChIInChI=1S/C21H14N2O3/c24-20-14(21(25)26)9-13-11-5-2-4-8-17(11)23-19(13)18(20)15-10-22-16-7-3-1-6-12(15)16/h1-10,22-24H,(H,25,26)
InChIKeyUPORVYGDZIGCGB-UHFFFAOYSA-N
XLogP4.87
TPSA89.11 Ų
H-Bond Donors4
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.35
LogP ≤ 54.87
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 102

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Related Compounds

Carmoxirole
CID 57364
Heptaphylline
CID 5318015
3-(6-hydroxy-1H-indol-3-yl)-4-(1H-indol-3-yl)-2,5-dihydro-1H-pyrrole-2,5-dione
CID 5327725
Mukonal
CID 504068
Mukonidine
CID 10999153
7-Hydroxyheptaphylline
CID 15767846
Indolo[6,7-a]pyrrolo[3,4-c]carbazole deriv. 3t
CID 5330738
Xanthine oxidase-IN-1
CID 25052183
Indolo[6,7-a]pyrrolo[3,4-c]carbazole deriv. 3s
CID 5330737
4-[({[3-(2-hydroxy-3-{1H-pyrrolo[3,2-c]pyridin-2-yl}phenyl)phenyl]methyl}carbamoyl)amino]benzoic acid
CID 23646870
3-(1-(3-(biphenyl-4-ylamino)-3-oxopropyl)-1H-1,2,3-triazol-4-yl)-6-hydroxy-1-methyl-2-phenyl-1H-indole-5-carboxylic acid
CID 25262527
5-[4-(2,6-dihydroxyphenyl)phenyl]-1H-indole-3-carboxylic acid
CID 77108135

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-1-(1H-indol-3-yl)-9H-carbazole-3-carboxylic acid?
The IUPAC name of 2-hydroxy-1-(1H-indol-3-yl)-9H-carbazole-3-carboxylic acid (CID 10291090) is 2-hydroxy-1-(1H-indol-3-yl)-9H-carbazole-3-carboxylic acid.
What is the SMILES notation for 2-hydroxy-1-(1H-indol-3-yl)-9H-carbazole-3-carboxylic acid?
The canonical SMILES for 2-hydroxy-1-(1H-indol-3-yl)-9H-carbazole-3-carboxylic acid is O=C(O)c1cc2c([nH]c3ccccc32)c(-c2c[nH]c3ccccc23)c1O.
What is the InChIKey of 2-hydroxy-1-(1H-indol-3-yl)-9H-carbazole-3-carboxylic acid?
The InChIKey is UPORVYGDZIGCGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H14N2O3/c24-20-14(21(25)26)9-13-11-5-2-4-8-17(11)23-19(13)18(20)15-10-22-16-7-3-1-6-12(15)16/h1-10,22-24H,(H,25,26).
What are the key properties of 2-hydroxy-1-(1H-indol-3-yl)-9H-carbazole-3-carboxylic acid?
2-hydroxy-1-(1H-indol-3-yl)-9H-carbazole-3-carboxylic acid has a molecular weight of 342.35 g/mol, XLogP of 4.87, 2 rotatable bonds, 4 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-1-(1H-indol-3-yl)-9H-carbazole-3-carboxylic acid is sourced from PubChem (CID 10291090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).