N-[1-(2-ethoxyethyl)-2-hydroxyindol-3-yl]imino-2-(2-oxo-1-pyridinyl)acetamide

C19H20N4O4 — CID 135702543

IUPACN-[1-(2-ethoxyethyl)-2-hydroxyindol-3-yl]imino-2-(2-oxo-1-pyridinyl)acetamide
SMILESCCOCCn1c(O)c(/N=N/C(=O)Cn2ccccc2=O)c2ccccc21
InChIInChI=1S/C19H20N4O4/c1-2-27-12-11-23-15-8-4-3-7-14(15)18(19(23)26)21-20-16(24)13-22-10-6-5-9-17(22)25/h3-10,26H,2,11-13H2,1H3/b21-20+
InChIKeyAJXGBCLLCAAMBL-QZQOTICOSA-N
MW368.39 g/mol
LogP2.86
Rot. Bonds7

About N-[1-(2-ethoxyethyl)-2-hydroxyindol-3-yl]imino-2-(2-oxo-1-pyridinyl)acetamide

N-[1-(2-ethoxyethyl)-2-hydroxyindol-3-yl]imino-2-(2-oxo-1-pyridinyl)acetamide (PubChem CID 135702543) has the molecular formula C19H20N4O4 and a molecular weight of 368.39 g/mol. Its IUPAC name is N-[1-(2-ethoxyethyl)-2-hydroxyindol-3-yl]imino-2-(2-oxo-1-pyridinyl)acetamide.

Molecular Properties

Compound NameN-[1-(2-ethoxyethyl)-2-hydroxyindol-3-yl]imino-2-(2-oxo-1-pyridinyl)acetamide
PubChem CID135702543
Molecular FormulaC19H20N4O4
Molecular Weight368.39 g/mol
Exact Mass368.15
IUPAC NameN-[1-(2-ethoxyethyl)-2-hydroxyindol-3-yl]imino-2-(2-oxo-1-pyridinyl)acetamide
SMILESCCOCCn1c(O)c(/N=N/C(=O)Cn2ccccc2=O)c2ccccc21
InChIInChI=1S/C19H20N4O4/c1-2-27-12-11-23-15-8-4-3-7-14(15)18(19(23)26)21-20-16(24)13-22-10-6-5-9-17(22)25/h3-10,26H,2,11-13H2,1H3/b21-20+
InChIKeyAJXGBCLLCAAMBL-QZQOTICOSA-N
XLogP2.86
TPSA98.18 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.39
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}

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Related Compounds

N-[1-(2-ethoxyethyl)-2-hydroxyindol-3-yl]imino-2-methylbenzamide
CID 135426572
2-(3,5-dimethylphenoxy)-N-[1-(2-ethoxyethyl)-2-hydroxyindol-3-yl]iminoacetamide
CID 135674746
N-[1-(2-ethoxyethyl)-2-hydroxyindol-3-yl]imino-3,4-dimethoxybenzamide
CID 135710555
N-[1-(2-ethoxyethyl)-2-hydroxyindol-3-yl]iminothiophene-2-carboxamide
CID 135577019
2-[[1-(2-ethoxyethyl)-2-hydroxyindol-3-yl]diazenyl]-4-methyl-1H-pyrimidin-6-one
CID 135824238
ethyl 2-[2-hydroxy-3-[[2-(2-oxoazepan-1-yl)acetyl]diazenyl]indol-1-yl]acetate
CID 135725774
N-(2-hydroxy-1-propylindol-3-yl)iminobenzamide
CID 5030390
methyl N-(2-hydroxy-1-pentylindol-3-yl)iminocarbamate
CID 2692604
N-(1-ethyl-2-hydroxyindol-3-yl)imino-2-phenoxyacetamide
CID 963929
ethyl 2-[3-[[2-(2,4-dimethylphenoxy)acetyl]diazenyl]-2-hydroxyindol-1-yl]acetate
CID 135957357
N,N'-bis[(2-hydroxy-1-propylindol-3-yl)imino]propanediamide;propanedihydrazide
CID 135810850
2-(2-chlorophenoxy)-N-(1-ethyl-2-hydroxyindol-3-yl)iminoacetamide
CID 135674715

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-ethoxyethyl)-2-hydroxyindol-3-yl]imino-2-(2-oxo-1-pyridinyl)acetamide?
The IUPAC name of N-[1-(2-ethoxyethyl)-2-hydroxyindol-3-yl]imino-2-(2-oxo-1-pyridinyl)acetamide (CID 135702543) is N-[1-(2-ethoxyethyl)-2-hydroxyindol-3-yl]imino-2-(2-oxo-1-pyridinyl)acetamide.
What is the SMILES notation for N-[1-(2-ethoxyethyl)-2-hydroxyindol-3-yl]imino-2-(2-oxo-1-pyridinyl)acetamide?
The canonical SMILES for N-[1-(2-ethoxyethyl)-2-hydroxyindol-3-yl]imino-2-(2-oxo-1-pyridinyl)acetamide is CCOCCn1c(O)c(/N=N/C(=O)Cn2ccccc2=O)c2ccccc21.
What is the InChIKey of N-[1-(2-ethoxyethyl)-2-hydroxyindol-3-yl]imino-2-(2-oxo-1-pyridinyl)acetamide?
The InChIKey is AJXGBCLLCAAMBL-QZQOTICOSA-N. The full InChI is InChI=1S/C19H20N4O4/c1-2-27-12-11-23-15-8-4-3-7-14(15)18(19(23)26)21-20-16(24)13-22-10-6-5-9-17(22)25/h3-10,26H,2,11-13H2,1H3/b21-20+.
What are the key properties of N-[1-(2-ethoxyethyl)-2-hydroxyindol-3-yl]imino-2-(2-oxo-1-pyridinyl)acetamide?
N-[1-(2-ethoxyethyl)-2-hydroxyindol-3-yl]imino-2-(2-oxo-1-pyridinyl)acetamide has a molecular weight of 368.39 g/mol, XLogP of 2.86, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-ethoxyethyl)-2-hydroxyindol-3-yl]imino-2-(2-oxo-1-pyridinyl)acetamide is sourced from PubChem (CID 135702543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).