2-(3-ethoxycyclobutyl)-N-(2-iodophenyl)acetamide

C14H18INO2 — CID 103163808

IUPAC2-(3-ethoxycyclobutyl)-N-(2-iodophenyl)acetamide
SMILESCCOC1CC(CC(=O)Nc2ccccc2I)C1
InChIInChI=1S/C14H18INO2/c1-2-18-11-7-10(8-11)9-14(17)16-13-6-4-3-5-12(13)15/h3-6,10-11H,2,7-9H2,1H3,(H,16,17)
InChIKeyCSEKDLAAVKCSDG-UHFFFAOYSA-N
MW359.21 g/mol
LogP3.43
Rot. Bonds5

About 2-(3-ethoxycyclobutyl)-N-(2-iodophenyl)acetamide

2-(3-ethoxycyclobutyl)-N-(2-iodophenyl)acetamide (PubChem CID 103163808) has the molecular formula C14H18INO2 and a molecular weight of 359.21 g/mol. Its IUPAC name is 2-(3-ethoxycyclobutyl)-N-(2-iodophenyl)acetamide.

Molecular Properties

Compound Name2-(3-ethoxycyclobutyl)-N-(2-iodophenyl)acetamide
PubChem CID103163808
Molecular FormulaC14H18INO2
Molecular Weight359.21 g/mol
Exact Mass359.04
IUPAC Name2-(3-ethoxycyclobutyl)-N-(2-iodophenyl)acetamide
SMILESCCOC1CC(CC(=O)Nc2ccccc2I)C1
InChIInChI=1S/C14H18INO2/c1-2-18-11-7-10(8-11)9-14(17)16-13-6-4-3-5-12(13)15/h3-6,10-11H,2,7-9H2,1H3,(H,16,17)
InChIKeyCSEKDLAAVKCSDG-UHFFFAOYSA-N
XLogP3.43
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.21
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[2-(chloromethyl)phenyl]-2-(3-ethoxycyclobutyl)acetamide
CID 103166704
3-[[2-(3-ethoxycyclobutyl)acetyl]amino]-2-methylbenzoic acid
CID 103161884
2-cyclobutyl-N-(2-iodophenyl)acetamide
CID 103706273
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(2-iodophenyl)acetamide
CID 79606850
N-(2-carbamothioyl-3-methylphenyl)-2-(3-ethoxycyclobutyl)acetamide
CID 107805706
N-(2-amino-4-hydroxyphenyl)-2-(3-ethoxycyclobutyl)acetamide
CID 107697268
N-(2-bromo-4-hydroxyphenyl)-2-(3-ethoxycyclobutyl)acetamide
CID 138015104
N-(2-bromo-5-fluorophenyl)-2-(3-ethoxycyclobutyl)acetamide
CID 103270141
2-(3-ethoxycyclobutyl)-N-(1H-indazol-3-yl)acetamide
CID 103164819
5-chloro-2-[[2-(3-ethoxycyclobutyl)acetyl]amino]benzoic acid
CID 103161729
N-(2-iodophenyl)-2-piperidin-3-ylacetamide
CID 62676298
N-(3,5-dichloro-2-hydroxyphenyl)-2-(3-ethoxycyclobutyl)acetamide
CID 103279698

Frequently Asked Questions

What is the IUPAC name of 2-(3-ethoxycyclobutyl)-N-(2-iodophenyl)acetamide?
The IUPAC name of 2-(3-ethoxycyclobutyl)-N-(2-iodophenyl)acetamide (CID 103163808) is 2-(3-ethoxycyclobutyl)-N-(2-iodophenyl)acetamide.
What is the SMILES notation for 2-(3-ethoxycyclobutyl)-N-(2-iodophenyl)acetamide?
The canonical SMILES for 2-(3-ethoxycyclobutyl)-N-(2-iodophenyl)acetamide is CCOC1CC(CC(=O)Nc2ccccc2I)C1.
What is the InChIKey of 2-(3-ethoxycyclobutyl)-N-(2-iodophenyl)acetamide?
The InChIKey is CSEKDLAAVKCSDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18INO2/c1-2-18-11-7-10(8-11)9-14(17)16-13-6-4-3-5-12(13)15/h3-6,10-11H,2,7-9H2,1H3,(H,16,17).
What are the key properties of 2-(3-ethoxycyclobutyl)-N-(2-iodophenyl)acetamide?
2-(3-ethoxycyclobutyl)-N-(2-iodophenyl)acetamide has a molecular weight of 359.21 g/mol, XLogP of 3.43, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethoxycyclobutyl)-N-(2-iodophenyl)acetamide is sourced from PubChem (CID 103163808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).