2-[furan-2-ylmethyl(methyl)amino]-N-(2-iodophenyl)acetamide

C14H15IN2O2 — CID 9334115

IUPAC2-[furan-2-ylmethyl(methyl)amino]-N-(2-iodophenyl)acetamide
SMILESCN(CC(=O)Nc1ccccc1I)Cc1ccco1
InChIInChI=1S/C14H15IN2O2/c1-17(9-11-5-4-8-19-11)10-14(18)16-13-7-3-2-6-12(13)15/h2-8H,9-10H2,1H3,(H,16,18)
InChIKeyROLJNXCHMIXKNO-UHFFFAOYSA-N
MW370.19 g/mol
LogP2.95
Rot. Bonds5

About 2-[furan-2-ylmethyl(methyl)amino]-N-(2-iodophenyl)acetamide

2-[furan-2-ylmethyl(methyl)amino]-N-(2-iodophenyl)acetamide (PubChem CID 9334115) has the molecular formula C14H15IN2O2 and a molecular weight of 370.19 g/mol. Its IUPAC name is 2-[furan-2-ylmethyl(methyl)amino]-N-(2-iodophenyl)acetamide.

Molecular Properties

Compound Name2-[furan-2-ylmethyl(methyl)amino]-N-(2-iodophenyl)acetamide
PubChem CID9334115
Molecular FormulaC14H15IN2O2
Molecular Weight370.19 g/mol
Exact Mass370.02
IUPAC Name2-[furan-2-ylmethyl(methyl)amino]-N-(2-iodophenyl)acetamide
SMILESCN(CC(=O)Nc1ccccc1I)Cc1ccco1
InChIInChI=1S/C14H15IN2O2/c1-17(9-11-5-4-8-19-11)10-14(18)16-13-7-3-2-6-12(13)15/h2-8H,9-10H2,1H3,(H,16,18)
InChIKeyROLJNXCHMIXKNO-UHFFFAOYSA-N
XLogP2.95
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.19
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(2-bromophenyl)-2-[[2-[furan-2-ylmethyl(methyl)amino]acetyl]amino]acetamide
CID 8620903
N-(5-amino-2-methylphenyl)-2-[furan-2-ylmethyl(methyl)amino]acetamide
CID 43526619
N-(4-tert-butylphenyl)-2-[furan-2-ylmethyl(methyl)amino]acetamide
CID 31379581
N-benzhydryl-2-[furan-2-ylmethyl(methyl)amino]acetamide
CID 9333528
2-[furan-2-ylmethyl(methyl)amino]-N-(1,3-thiazol-2-yl)acetamide
CID 18134048
N-(2-cyanophenyl)-3-[furan-2-ylmethyl(methyl)amino]propanamide
CID 37465986
N-[4-(dimethylsulfamoyl)phenyl]-2-[furan-2-ylmethyl(methyl)amino]acetamide
CID 9331913
N-(5-chloro-2-nitrophenyl)-2-[furan-2-ylmethyl(methyl)amino]acetamide
CID 9334177
N-cyclopropyl-2-[[2-(2-iodoanilino)-2-oxoethyl]-methylamino]acetamide
CID 9053773
2-[furan-2-ylmethyl(methyl)amino]-1-(4-iodophenyl)ethanone
CID 62051012
1-[furan-2-ylmethyl(methyl)amino]butan-2-one
CID 62038679
2-[furan-2-ylmethyl(methyl)amino]-N-[3-(trifluoromethyl)phenyl]acetamide
CID 9333158

Frequently Asked Questions

What is the IUPAC name of 2-[furan-2-ylmethyl(methyl)amino]-N-(2-iodophenyl)acetamide?
The IUPAC name of 2-[furan-2-ylmethyl(methyl)amino]-N-(2-iodophenyl)acetamide (CID 9334115) is 2-[furan-2-ylmethyl(methyl)amino]-N-(2-iodophenyl)acetamide.
What is the SMILES notation for 2-[furan-2-ylmethyl(methyl)amino]-N-(2-iodophenyl)acetamide?
The canonical SMILES for 2-[furan-2-ylmethyl(methyl)amino]-N-(2-iodophenyl)acetamide is CN(CC(=O)Nc1ccccc1I)Cc1ccco1.
What is the InChIKey of 2-[furan-2-ylmethyl(methyl)amino]-N-(2-iodophenyl)acetamide?
The InChIKey is ROLJNXCHMIXKNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15IN2O2/c1-17(9-11-5-4-8-19-11)10-14(18)16-13-7-3-2-6-12(13)15/h2-8H,9-10H2,1H3,(H,16,18).
What are the key properties of 2-[furan-2-ylmethyl(methyl)amino]-N-(2-iodophenyl)acetamide?
2-[furan-2-ylmethyl(methyl)amino]-N-(2-iodophenyl)acetamide has a molecular weight of 370.19 g/mol, XLogP of 2.95, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[furan-2-ylmethyl(methyl)amino]-N-(2-iodophenyl)acetamide is sourced from PubChem (CID 9334115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).