2-(2-amino-2-oxoethyl)-4-hydroxy-1H-indole-3-carboxamide

C11H11N3O3 — CID 58280297

IUPAC2-(2-amino-2-oxoethyl)-4-hydroxy-1H-indole-3-carboxamide
SMILESNC(=O)Cc1[nH]c2cccc(O)c2c1C(N)=O
InChIInChI=1S/C11H11N3O3/c12-8(16)4-6-10(11(13)17)9-5(14-6)2-1-3-7(9)15/h1-3,14-15H,4H2,(H2,12,16)(H2,13,17)
InChIKeyMZPXOOIOJJGIEG-UHFFFAOYSA-N
MW233.23 g/mol
LogP0.00
Rot. Bonds3

About 2-(2-amino-2-oxoethyl)-4-hydroxy-1H-indole-3-carboxamide

2-(2-amino-2-oxoethyl)-4-hydroxy-1H-indole-3-carboxamide (PubChem CID 58280297) has the molecular formula C11H11N3O3 and a molecular weight of 233.23 g/mol. Its IUPAC name is 2-(2-amino-2-oxoethyl)-4-hydroxy-1H-indole-3-carboxamide.

Molecular Properties

Compound Name2-(2-amino-2-oxoethyl)-4-hydroxy-1H-indole-3-carboxamide
PubChem CID58280297
Molecular FormulaC11H11N3O3
Molecular Weight233.23 g/mol
Exact Mass233.08
IUPAC Name2-(2-amino-2-oxoethyl)-4-hydroxy-1H-indole-3-carboxamide
SMILESNC(=O)Cc1[nH]c2cccc(O)c2c1C(N)=O
InChIInChI=1S/C11H11N3O3/c12-8(16)4-6-10(11(13)17)9-5(14-6)2-1-3-7(9)15/h1-3,14-15H,4H2,(H2,12,16)(H2,13,17)
InChIKeyMZPXOOIOJJGIEG-UHFFFAOYSA-N
XLogP0.00
TPSA122.20 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.23
LogP ≤ 50.00
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-(carboxymethyl)-4-hydroxy-1H-indol-3-yl]acetic acid
CID 134812921
2-(4-hydroxy-1H-indol-2-yl)acetamide
CID 139709684
2-[5-chloro-3-(2-phenylethyl)-4-sulfanylidene-1H-quinolin-2-yl]acetamide
CID 143751615
4-ethyl-2-phenyl-1H-indole-3-carboxamide
CID 71082978
2-(aminomethyl)-3-bromo-1H-indol-4-ol
CID 84702327
2-(2-amino-2-oxoethyl)-6-(ethylsulfanylmethyl)-1H-indole-3-carboxamide
CID 158705289
2-(2-amino-2-oxoethyl)-6-(4-phenylbutanoyl)-1H-indole-3-carboxamide
CID 161113640
2-(bromomethyl)-6-hydroxybenzamide
CID 133057810
8-[(2-fluorophenyl)methyl]-5-hydroxy-9H-carbazole-4-carboxamide
CID 67567954
2-(2-amino-2-oxoethyl)-6-[4-(3-methoxyphenyl)butanoyl]-1H-indole-3-carboxamide
CID 157118543
2-[(4-hydroxy-2-methyl-1H-indole-3-carbonyl)-methylamino]acetic acid
CID 110835901
[2-(2-amino-2-oxoethyl)-1H-indol-3-yl] 2,2,2-trichloroacetate
CID 139664215

Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-2-oxoethyl)-4-hydroxy-1H-indole-3-carboxamide?
The IUPAC name of 2-(2-amino-2-oxoethyl)-4-hydroxy-1H-indole-3-carboxamide (CID 58280297) is 2-(2-amino-2-oxoethyl)-4-hydroxy-1H-indole-3-carboxamide.
What is the SMILES notation for 2-(2-amino-2-oxoethyl)-4-hydroxy-1H-indole-3-carboxamide?
The canonical SMILES for 2-(2-amino-2-oxoethyl)-4-hydroxy-1H-indole-3-carboxamide is NC(=O)Cc1[nH]c2cccc(O)c2c1C(N)=O.
What is the InChIKey of 2-(2-amino-2-oxoethyl)-4-hydroxy-1H-indole-3-carboxamide?
The InChIKey is MZPXOOIOJJGIEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N3O3/c12-8(16)4-6-10(11(13)17)9-5(14-6)2-1-3-7(9)15/h1-3,14-15H,4H2,(H2,12,16)(H2,13,17).
What are the key properties of 2-(2-amino-2-oxoethyl)-4-hydroxy-1H-indole-3-carboxamide?
2-(2-amino-2-oxoethyl)-4-hydroxy-1H-indole-3-carboxamide has a molecular weight of 233.23 g/mol, XLogP of 0.00, 3 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-amino-2-oxoethyl)-4-hydroxy-1H-indole-3-carboxamide is sourced from PubChem (CID 58280297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).