2-(3-amino-3-oxopropoxy)benzamide

C10H12N2O3 — CID 60713061

IUPAC2-(3-amino-3-oxopropoxy)benzamide
SMILESNC(=O)CCOc1ccccc1C(N)=O
InChIInChI=1S/C10H12N2O3/c11-9(13)5-6-15-8-4-2-1-3-7(8)10(12)14/h1-4H,5-6H2,(H2,11,13)(H2,12,14)
InChIKeyQXLNGMMYWNPIHZ-UHFFFAOYSA-N
MW208.22 g/mol
LogP0.04
Rot. Bonds5

About 2-(3-amino-3-oxopropoxy)benzamide

2-(3-amino-3-oxopropoxy)benzamide (PubChem CID 60713061) has the molecular formula C10H12N2O3 and a molecular weight of 208.22 g/mol. Its IUPAC name is 2-(3-amino-3-oxopropoxy)benzamide.

Molecular Properties

Compound Name2-(3-amino-3-oxopropoxy)benzamide
PubChem CID60713061
Molecular FormulaC10H12N2O3
Molecular Weight208.22 g/mol
Exact Mass208.08
IUPAC Name2-(3-amino-3-oxopropoxy)benzamide
SMILESNC(=O)CCOc1ccccc1C(N)=O
InChIInChI=1S/C10H12N2O3/c11-9(13)5-6-15-8-4-2-1-3-7(8)10(12)14/h1-4H,5-6H2,(H2,11,13)(H2,12,14)
InChIKeyQXLNGMMYWNPIHZ-UHFFFAOYSA-N
XLogP0.04
TPSA95.41 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.22
LogP ≤ 50.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(3-amino-3-oxopropoxy)benzamide with MolForge

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

Launch Full Analysis

Related Compounds

2-(4-amino-4-sulfanylidenebutoxy)benzamide
CID 24698755
3-(2-aminophenoxy)propanamide
CID 39869131
2-(4-methoxybutoxy)benzamide;dihydrochloride
CID 140972471
5-amino-2-(3-amino-3-oxopropoxy)benzamide
CID 106956094
2-[3-(tert-butylamino)propoxy]benzamide
CID 103074303
2-(3-oxo-3-piperazin-1-ylpropoxy)benzamide
CID 62543936
2-(fluoromethoxy)benzamide;hydrochloride
CID 141068067
2-(2-oxoethoxy)benzamide
CID 21273663
(3-amino-3-oxopropyl) 3-(2-aminophenoxy)propanoate
CID 61314280
2-(3-azidopropoxy)benzamide
CID 61396560
2-(2-cyclopropyl-2-oxoethoxy)benzamide
CID 63913562
(2-carbamoylphenyl) hydrogen carbonate
CID 91199327

Frequently Asked Questions

What is the IUPAC name of 2-(3-amino-3-oxopropoxy)benzamide?
The IUPAC name of 2-(3-amino-3-oxopropoxy)benzamide (CID 60713061) is 2-(3-amino-3-oxopropoxy)benzamide.
What is the SMILES notation for 2-(3-amino-3-oxopropoxy)benzamide?
The canonical SMILES for 2-(3-amino-3-oxopropoxy)benzamide is NC(=O)CCOc1ccccc1C(N)=O.
What is the InChIKey of 2-(3-amino-3-oxopropoxy)benzamide?
The InChIKey is QXLNGMMYWNPIHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O3/c11-9(13)5-6-15-8-4-2-1-3-7(8)10(12)14/h1-4H,5-6H2,(H2,11,13)(H2,12,14).
What are the key properties of 2-(3-amino-3-oxopropoxy)benzamide?
2-(3-amino-3-oxopropoxy)benzamide has a molecular weight of 208.22 g/mol, XLogP of 0.04, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-amino-3-oxopropoxy)benzamide is sourced from PubChem (CID 60713061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).