N-(3-phthalazin-1-yloxyphenyl)acetamide

C16H13N3O2 — CID 6410691

IUPACN-(3-phthalazin-1-yloxyphenyl)acetamide
SMILESCC(=O)Nc1cccc(Oc2nncc3ccccc23)c1
InChIInChI=1S/C16H13N3O2/c1-11(20)18-13-6-4-7-14(9-13)21-16-15-8-3-2-5-12(15)10-17-19-16/h2-10H,1H3,(H,18,20)
InChIKeyWNOLWISYOMISMT-UHFFFAOYSA-N
MW279.30 g/mol
LogP3.38
Rot. Bonds3

About N-(3-phthalazin-1-yloxyphenyl)acetamide

N-(3-phthalazin-1-yloxyphenyl)acetamide (PubChem CID 6410691) has the molecular formula C16H13N3O2 and a molecular weight of 279.30 g/mol. Its IUPAC name is N-(3-phthalazin-1-yloxyphenyl)acetamide.

Molecular Properties

Compound NameN-(3-phthalazin-1-yloxyphenyl)acetamide
PubChem CID6410691
Molecular FormulaC16H13N3O2
Molecular Weight279.30 g/mol
Exact Mass279.10
IUPAC NameN-(3-phthalazin-1-yloxyphenyl)acetamide
SMILESCC(=O)Nc1cccc(Oc2nncc3ccccc23)c1
InChIInChI=1S/C16H13N3O2/c1-11(20)18-13-6-4-7-14(9-13)21-16-15-8-3-2-5-12(15)10-17-19-16/h2-10H,1H3,(H,18,20)
InChIKeyWNOLWISYOMISMT-UHFFFAOYSA-N
XLogP3.38
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.30
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(3-phthalazin-1-yloxyphenyl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(3-phthalazin-1-yloxyphenyl)acetamide?
The IUPAC name of N-(3-phthalazin-1-yloxyphenyl)acetamide (CID 6410691) is N-(3-phthalazin-1-yloxyphenyl)acetamide.
What is the SMILES notation for N-(3-phthalazin-1-yloxyphenyl)acetamide?
The canonical SMILES for N-(3-phthalazin-1-yloxyphenyl)acetamide is CC(=O)Nc1cccc(Oc2nncc3ccccc23)c1.
What is the InChIKey of N-(3-phthalazin-1-yloxyphenyl)acetamide?
The InChIKey is WNOLWISYOMISMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13N3O2/c1-11(20)18-13-6-4-7-14(9-13)21-16-15-8-3-2-5-12(15)10-17-19-16/h2-10H,1H3,(H,18,20).
What are the key properties of N-(3-phthalazin-1-yloxyphenyl)acetamide?
N-(3-phthalazin-1-yloxyphenyl)acetamide has a molecular weight of 279.30 g/mol, XLogP of 3.38, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-phthalazin-1-yloxyphenyl)acetamide is sourced from PubChem (CID 6410691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).