2-hydroxyimino-N-[2-(1H-indol-3-yl)phenyl]acetamide

C16H13N3O2 — CID 174651173

IUPAC2-hydroxyimino-N-[2-(1H-indol-3-yl)phenyl]acetamide
SMILESO=C(C=NO)Nc1ccccc1-c1c[nH]c2ccccc12
InChIInChI=1S/C16H13N3O2/c20-16(10-18-21)19-15-8-4-2-6-12(15)13-9-17-14-7-3-1-5-11(13)14/h1-10,17,21H,(H,19,20)
InChIKeyOBWIAZHPYWOLGH-UHFFFAOYSA-N
MW279.30 g/mol
LogP3.23
Rot. Bonds3

About 2-hydroxyimino-N-[2-(1H-indol-3-yl)phenyl]acetamide

2-hydroxyimino-N-[2-(1H-indol-3-yl)phenyl]acetamide (PubChem CID 174651173) has the molecular formula C16H13N3O2 and a molecular weight of 279.30 g/mol. Its IUPAC name is 2-hydroxyimino-N-[2-(1H-indol-3-yl)phenyl]acetamide.

Molecular Properties

Compound Name2-hydroxyimino-N-[2-(1H-indol-3-yl)phenyl]acetamide
PubChem CID174651173
Molecular FormulaC16H13N3O2
Molecular Weight279.30 g/mol
Exact Mass279.10
IUPAC Name2-hydroxyimino-N-[2-(1H-indol-3-yl)phenyl]acetamide
SMILESO=C(C=NO)Nc1ccccc1-c1c[nH]c2ccccc12
InChIInChI=1S/C16H13N3O2/c20-16(10-18-21)19-15-8-4-2-6-12(15)13-9-17-14-7-3-1-5-11(13)14/h1-10,17,21H,(H,19,20)
InChIKeyOBWIAZHPYWOLGH-UHFFFAOYSA-N
XLogP3.23
TPSA77.48 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.30
LogP ≤ 53.23
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxyimino-N-[2-(1H-indol-3-yl)phenyl]acetamide?
The IUPAC name of 2-hydroxyimino-N-[2-(1H-indol-3-yl)phenyl]acetamide (CID 174651173) is 2-hydroxyimino-N-[2-(1H-indol-3-yl)phenyl]acetamide.
What is the SMILES notation for 2-hydroxyimino-N-[2-(1H-indol-3-yl)phenyl]acetamide?
The canonical SMILES for 2-hydroxyimino-N-[2-(1H-indol-3-yl)phenyl]acetamide is O=C(C=NO)Nc1ccccc1-c1c[nH]c2ccccc12.
What is the InChIKey of 2-hydroxyimino-N-[2-(1H-indol-3-yl)phenyl]acetamide?
The InChIKey is OBWIAZHPYWOLGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13N3O2/c20-16(10-18-21)19-15-8-4-2-6-12(15)13-9-17-14-7-3-1-5-11(13)14/h1-10,17,21H,(H,19,20).
What are the key properties of 2-hydroxyimino-N-[2-(1H-indol-3-yl)phenyl]acetamide?
2-hydroxyimino-N-[2-(1H-indol-3-yl)phenyl]acetamide has a molecular weight of 279.30 g/mol, XLogP of 3.23, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxyimino-N-[2-(1H-indol-3-yl)phenyl]acetamide is sourced from PubChem (CID 174651173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).