N-(7-amino-2-oxabicyclo[4.2.0]octan-8-yl)-2-ethoxybenzamide

C16H22N2O3 — CID 66211142

IUPACN-(7-amino-2-oxabicyclo[4.2.0]octan-8-yl)-2-ethoxybenzamide
SMILESCCOc1ccccc1C(=O)NC1C(N)C2CCCOC21
InChIInChI=1S/C16H22N2O3/c1-2-20-12-8-4-3-6-10(12)16(19)18-14-13(17)11-7-5-9-21-15(11)14/h3-4,6,8,11,13-15H,2,5,7,9,17H2,1H3,(H,18,19)
InChIKeyOPAASRCRTDBUGD-UHFFFAOYSA-N
MW290.36 g/mol
LogP1.32
Rot. Bonds4

About N-(7-amino-2-oxabicyclo[4.2.0]octan-8-yl)-2-ethoxybenzamide

N-(7-amino-2-oxabicyclo[4.2.0]octan-8-yl)-2-ethoxybenzamide (PubChem CID 66211142) has the molecular formula C16H22N2O3 and a molecular weight of 290.36 g/mol. Its IUPAC name is N-(7-amino-2-oxabicyclo[4.2.0]octan-8-yl)-2-ethoxybenzamide.

Molecular Properties

Compound NameN-(7-amino-2-oxabicyclo[4.2.0]octan-8-yl)-2-ethoxybenzamide
PubChem CID66211142
Molecular FormulaC16H22N2O3
Molecular Weight290.36 g/mol
Exact Mass290.16
IUPAC NameN-(7-amino-2-oxabicyclo[4.2.0]octan-8-yl)-2-ethoxybenzamide
SMILESCCOc1ccccc1C(=O)NC1C(N)C2CCCOC21
InChIInChI=1S/C16H22N2O3/c1-2-20-12-8-4-3-6-10(12)16(19)18-14-13(17)11-7-5-9-21-15(11)14/h3-4,6,8,11,13-15H,2,5,7,9,17H2,1H3,(H,18,19)
InChIKeyOPAASRCRTDBUGD-UHFFFAOYSA-N
XLogP1.32
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.36
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(7-amino-2-oxabicyclo[4.2.0]octan-8-yl)-2-ethoxybenzamide 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

N-(7-amino-2-oxabicyclo[4.2.0]octan-8-yl)-2,3-dihydroxybenzamide
CID 114345078
N-(7-amino-2-oxabicyclo[4.2.0]octan-8-yl)-3-chloro-2-methylbenzamide
CID 107098242
N-(7-amino-2-oxabicyclo[4.2.0]octan-8-yl)-4-fluorobenzamide
CID 66211147
N-(7-amino-2-oxabicyclo[4.2.0]octan-8-yl)-4-hydroxy-2-methylbenzamide
CID 107672151
N-(7-amino-2-oxabicyclo[4.2.0]octan-8-yl)-1H-indole-7-carboxamide
CID 66212891
N-[(1S,5S,6S,7R)-7-cyclopentyl-2-oxabicyclo[3.2.0]heptan-6-yl]-2-(2-ethoxyethoxy)benzamide
CID 91769104
2-ethoxy-N-[(3S,4R)-3-hydroxyoxan-4-yl]benzamide
CID 91765639
2-[(2-ethoxybenzoyl)amino]cyclohexane-1-carboxylic acid
CID 64814568
N-(7-amino-2-oxabicyclo[4.2.0]octan-8-yl)-5-bromo-2-fluorobenzamide
CID 66212893
2-ethoxy-N-[2-(N'-hydroxycarbamimidoyl)cyclopentyl]benzamide
CID 76978574
N-(7-amino-2-oxabicyclo[4.2.0]octan-8-yl)pyrazine-2-carboxamide
CID 66211143
N-(7-amino-2-oxabicyclo[4.2.0]octan-8-yl)-3-cyanobenzamide
CID 66210943

Frequently Asked Questions

What is the IUPAC name of N-(7-amino-2-oxabicyclo[4.2.0]octan-8-yl)-2-ethoxybenzamide?
The IUPAC name of N-(7-amino-2-oxabicyclo[4.2.0]octan-8-yl)-2-ethoxybenzamide (CID 66211142) is N-(7-amino-2-oxabicyclo[4.2.0]octan-8-yl)-2-ethoxybenzamide.
What is the SMILES notation for N-(7-amino-2-oxabicyclo[4.2.0]octan-8-yl)-2-ethoxybenzamide?
The canonical SMILES for N-(7-amino-2-oxabicyclo[4.2.0]octan-8-yl)-2-ethoxybenzamide is CCOc1ccccc1C(=O)NC1C(N)C2CCCOC21.
What is the InChIKey of N-(7-amino-2-oxabicyclo[4.2.0]octan-8-yl)-2-ethoxybenzamide?
The InChIKey is OPAASRCRTDBUGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O3/c1-2-20-12-8-4-3-6-10(12)16(19)18-14-13(17)11-7-5-9-21-15(11)14/h3-4,6,8,11,13-15H,2,5,7,9,17H2,1H3,(H,18,19).
What are the key properties of N-(7-amino-2-oxabicyclo[4.2.0]octan-8-yl)-2-ethoxybenzamide?
N-(7-amino-2-oxabicyclo[4.2.0]octan-8-yl)-2-ethoxybenzamide has a molecular weight of 290.36 g/mol, XLogP of 1.32, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(7-amino-2-oxabicyclo[4.2.0]octan-8-yl)-2-ethoxybenzamide is sourced from PubChem (CID 66211142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).