2-chloro-N-(2-hydroxy-1H-indol-5-yl)acetamide

C10H9ClN2O2 — CID 150237060

IUPAC2-chloro-N-(2-hydroxy-1H-indol-5-yl)acetamide
SMILESO=C(CCl)Nc1ccc2[nH]c(O)cc2c1
InChIInChI=1S/C10H9ClN2O2/c11-5-10(15)12-7-1-2-8-6(3-7)4-9(14)13-8/h1-4,13-14H,5H2,(H,12,15)
InChIKeyFWSSFZWFXBITBN-UHFFFAOYSA-N
MW224.65 g/mol
LogP2.05
Rot. Bonds2

About 2-chloro-N-(2-hydroxy-1H-indol-5-yl)acetamide

2-chloro-N-(2-hydroxy-1H-indol-5-yl)acetamide (PubChem CID 150237060) has the molecular formula C10H9ClN2O2 and a molecular weight of 224.65 g/mol. Its IUPAC name is 2-chloro-N-(2-hydroxy-1H-indol-5-yl)acetamide.

Molecular Properties

Compound Name2-chloro-N-(2-hydroxy-1H-indol-5-yl)acetamide
PubChem CID150237060
Molecular FormulaC10H9ClN2O2
Molecular Weight224.65 g/mol
Exact Mass224.04
IUPAC Name2-chloro-N-(2-hydroxy-1H-indol-5-yl)acetamide
SMILESO=C(CCl)Nc1ccc2[nH]c(O)cc2c1
InChIInChI=1S/C10H9ClN2O2/c11-5-10(15)12-7-1-2-8-6(3-7)4-9(14)13-8/h1-4,13-14H,5H2,(H,12,15)
InChIKeyFWSSFZWFXBITBN-UHFFFAOYSA-N
XLogP2.05
TPSA65.12 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.65
LogP ≤ 52.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(2-hydroxy-1H-indol-5-yl)acetamide?
The IUPAC name of 2-chloro-N-(2-hydroxy-1H-indol-5-yl)acetamide (CID 150237060) is 2-chloro-N-(2-hydroxy-1H-indol-5-yl)acetamide.
What is the SMILES notation for 2-chloro-N-(2-hydroxy-1H-indol-5-yl)acetamide?
The canonical SMILES for 2-chloro-N-(2-hydroxy-1H-indol-5-yl)acetamide is O=C(CCl)Nc1ccc2[nH]c(O)cc2c1.
What is the InChIKey of 2-chloro-N-(2-hydroxy-1H-indol-5-yl)acetamide?
The InChIKey is FWSSFZWFXBITBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9ClN2O2/c11-5-10(15)12-7-1-2-8-6(3-7)4-9(14)13-8/h1-4,13-14H,5H2,(H,12,15).
What are the key properties of 2-chloro-N-(2-hydroxy-1H-indol-5-yl)acetamide?
2-chloro-N-(2-hydroxy-1H-indol-5-yl)acetamide has a molecular weight of 224.65 g/mol, XLogP of 2.05, 2 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(2-hydroxy-1H-indol-5-yl)acetamide is sourced from PubChem (CID 150237060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).