N-(2-iodophenyl)-2-propan-2-yloxyacetamide

C11H14INO2 — CID 47416512

IUPACN-(2-iodophenyl)-2-propan-2-yloxyacetamide
SMILESCC(C)OCC(=O)Nc1ccccc1I
InChIInChI=1S/C11H14INO2/c1-8(2)15-7-11(14)13-10-6-4-3-5-9(10)12/h3-6,8H,7H2,1-2H3,(H,13,14)
InChIKeyPNBJBPYRRUVBSM-UHFFFAOYSA-N
MW319.14 g/mol
LogP2.65
Rot. Bonds4

About N-(2-iodophenyl)-2-propan-2-yloxyacetamide

N-(2-iodophenyl)-2-propan-2-yloxyacetamide (PubChem CID 47416512) has the molecular formula C11H14INO2 and a molecular weight of 319.14 g/mol. Its IUPAC name is N-(2-iodophenyl)-2-propan-2-yloxyacetamide.

Molecular Properties

Compound NameN-(2-iodophenyl)-2-propan-2-yloxyacetamide
PubChem CID47416512
Molecular FormulaC11H14INO2
Molecular Weight319.14 g/mol
Exact Mass319.01
IUPAC NameN-(2-iodophenyl)-2-propan-2-yloxyacetamide
SMILESCC(C)OCC(=O)Nc1ccccc1I
InChIInChI=1S/C11H14INO2/c1-8(2)15-7-11(14)13-10-6-4-3-5-9(10)12/h3-6,8H,7H2,1-2H3,(H,13,14)
InChIKeyPNBJBPYRRUVBSM-UHFFFAOYSA-N
XLogP2.65
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.14
LogP ≤ 52.65
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

2-propan-2-yloxy-N-(2-propan-2-yloxyphenyl)acetamide
CID 112687005
N-(2-iodophenyl)-2-(2-propan-2-ylphenoxy)acetamide
CID 7900625
N-[2-(difluoromethylsulfonyl)phenyl]-2-propan-2-yloxyacetamide
CID 115593870
2-(4-acetamidophenoxy)-N-(2-iodophenyl)acetamide
CID 7203363
2-(4-acetylphenoxy)-N-(2-iodophenyl)acetamide
CID 2621387
2-methylpropyl N-(2-iodophenyl)carbamate
CID 546432
5-amino-N-(2-iodophenyl)hexanamide
CID 82848467
methyl 2-[2-(2-iodoanilino)-2-oxoethoxy]benzoate
CID 7763964
(2S,3S)-2-[[2-(2-iodoanilino)-2-oxoethyl]amino]-3-methylpentanoic acid
CID 122099851
2-(2-tert-butylphenoxy)-N-(2-iodophenyl)acetamide
CID 36678366
[2-(2-iodoanilino)-2-oxoethyl] 2,6-dimethoxybenzoate
CID 2636059
2-acetamido-N-(2-iodophenyl)acetamide
CID 60635742

Frequently Asked Questions

What is the IUPAC name of N-(2-iodophenyl)-2-propan-2-yloxyacetamide?
The IUPAC name of N-(2-iodophenyl)-2-propan-2-yloxyacetamide (CID 47416512) is N-(2-iodophenyl)-2-propan-2-yloxyacetamide.
What is the SMILES notation for N-(2-iodophenyl)-2-propan-2-yloxyacetamide?
The canonical SMILES for N-(2-iodophenyl)-2-propan-2-yloxyacetamide is CC(C)OCC(=O)Nc1ccccc1I.
What is the InChIKey of N-(2-iodophenyl)-2-propan-2-yloxyacetamide?
The InChIKey is PNBJBPYRRUVBSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14INO2/c1-8(2)15-7-11(14)13-10-6-4-3-5-9(10)12/h3-6,8H,7H2,1-2H3,(H,13,14).
What are the key properties of N-(2-iodophenyl)-2-propan-2-yloxyacetamide?
N-(2-iodophenyl)-2-propan-2-yloxyacetamide has a molecular weight of 319.14 g/mol, XLogP of 2.65, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-iodophenyl)-2-propan-2-yloxyacetamide is sourced from PubChem (CID 47416512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).