N-[2-(cyclobutene-1-carbonylamino)ethyl]benzamide

C14H16N2O2 — CID 75440243

IUPACN-[2-(cyclobutene-1-carbonylamino)ethyl]benzamide
SMILESO=C(NCCNC(=O)c1ccccc1)C1=CCC1
InChIInChI=1S/C14H16N2O2/c17-13(11-5-2-1-3-6-11)15-9-10-16-14(18)12-7-4-8-12/h1-3,5-7H,4,8-10H2,(H,15,17)(H,16,18)
InChIKeyUWGCCLQKJRFOIG-UHFFFAOYSA-N
MW244.29 g/mol
LogP1.25
Rot. Bonds5

About N-[2-(cyclobutene-1-carbonylamino)ethyl]benzamide

N-[2-(cyclobutene-1-carbonylamino)ethyl]benzamide (PubChem CID 75440243) has the molecular formula C14H16N2O2 and a molecular weight of 244.29 g/mol. Its IUPAC name is N-[2-(cyclobutene-1-carbonylamino)ethyl]benzamide.

Molecular Properties

Compound NameN-[2-(cyclobutene-1-carbonylamino)ethyl]benzamide
PubChem CID75440243
Molecular FormulaC14H16N2O2
Molecular Weight244.29 g/mol
Exact Mass244.12
IUPAC NameN-[2-(cyclobutene-1-carbonylamino)ethyl]benzamide
SMILESO=C(NCCNC(=O)c1ccccc1)C1=CCC1
InChIInChI=1S/C14H16N2O2/c17-13(11-5-2-1-3-6-11)15-9-10-16-14(18)12-7-4-8-12/h1-3,5-7H,4,8-10H2,(H,15,17)(H,16,18)
InChIKeyUWGCCLQKJRFOIG-UHFFFAOYSA-N
XLogP1.25
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-[2-(cyclobutene-1-carbonylamino)ethyl]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

N-[2-[2-(2-benzamidoethylamino)ethylamino]ethyl]benzamide
CID 86227273
N-[2-(hydroxymethylamino)ethyl]benzamide
CID 89240823
N-[2-(methylcarbamoylamino)ethyl]benzamide
CID 47152136
N-(2-benzamidoethyl)-4-ethylbenzamide
CID 84532761
1-(2-benzamidoethylcarbamoyl)cyclopropane-1-carboxylic acid
CID 99699840
2-benzamidoethyl(chloro)mercury
CID 70399484
benzoic acid;N-(2-hydroxyethyl)benzamide
CID 68510330
N-(2-aminoethyl)benzamide;ethane
CID 143976252
N-(2-benzamidoethyl)-4-(dimethylamino)benzamide
CID 38175898
bis(3-benzamidopropanoic acid);piperazine
CID 3045072
N-[2-(1,3-dioxolan-2-yl)ethyl]benzamide
CID 14952151
N-(2-benzamidoethyl)-2-phenylpyrimidine-5-carboxamide
CID 47781848

Frequently Asked Questions

What is the IUPAC name of N-[2-(cyclobutene-1-carbonylamino)ethyl]benzamide?
The IUPAC name of N-[2-(cyclobutene-1-carbonylamino)ethyl]benzamide (CID 75440243) is N-[2-(cyclobutene-1-carbonylamino)ethyl]benzamide.
What is the SMILES notation for N-[2-(cyclobutene-1-carbonylamino)ethyl]benzamide?
The canonical SMILES for N-[2-(cyclobutene-1-carbonylamino)ethyl]benzamide is O=C(NCCNC(=O)c1ccccc1)C1=CCC1.
What is the InChIKey of N-[2-(cyclobutene-1-carbonylamino)ethyl]benzamide?
The InChIKey is UWGCCLQKJRFOIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2/c17-13(11-5-2-1-3-6-11)15-9-10-16-14(18)12-7-4-8-12/h1-3,5-7H,4,8-10H2,(H,15,17)(H,16,18).
What are the key properties of N-[2-(cyclobutene-1-carbonylamino)ethyl]benzamide?
N-[2-(cyclobutene-1-carbonylamino)ethyl]benzamide has a molecular weight of 244.29 g/mol, XLogP of 1.25, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(cyclobutene-1-carbonylamino)ethyl]benzamide is sourced from PubChem (CID 75440243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).