N-(3,5-dichloro-4-iodophenyl)acetamide

C8H6Cl2INO — CID 156599788

IUPACN-(3,5-dichloro-4-iodophenyl)acetamide
SMILESCC(=O)Nc1cc(Cl)c(I)c(Cl)c1
InChIInChI=1S/C8H6Cl2INO/c1-4(13)12-5-2-6(9)8(11)7(10)3-5/h2-3H,1H3,(H,12,13)
InChIKeyQRSKIQFTCZAYMS-UHFFFAOYSA-N
MW329.95 g/mol
LogP3.56
Rot. Bonds1

About N-(3,5-dichloro-4-iodophenyl)acetamide

N-(3,5-dichloro-4-iodophenyl)acetamide (PubChem CID 156599788) has the molecular formula C8H6Cl2INO and a molecular weight of 329.95 g/mol. Its IUPAC name is N-(3,5-dichloro-4-iodophenyl)acetamide.

Molecular Properties

Compound NameN-(3,5-dichloro-4-iodophenyl)acetamide
PubChem CID156599788
Molecular FormulaC8H6Cl2INO
Molecular Weight329.95 g/mol
Exact Mass328.89
IUPAC NameN-(3,5-dichloro-4-iodophenyl)acetamide
SMILESCC(=O)Nc1cc(Cl)c(I)c(Cl)c1
InChIInChI=1S/C8H6Cl2INO/c1-4(13)12-5-2-6(9)8(11)7(10)3-5/h2-3H,1H3,(H,12,13)
InChIKeyQRSKIQFTCZAYMS-UHFFFAOYSA-N
XLogP3.56
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.95
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

N-(3,5-diacetamidophenyl)acetamide
CID 12731559
N-(3,5-dichloro-4-cyanophenyl)acetamide
CID 134176863
N-(3-amino-5-chloro-4-hydroxyphenyl)acetamide
CID 70464969
N-(4-acetamido-2-chloro-6-methylphenyl)-N-methylcarbamate
CID 23161300
3,5-diacetamido-N-(3,4-dichlorophenyl)benzamide
CID 2524728
5-acetamido-2-amino-3-chlorobenzenesulfonic acid
CID 101429249
N-(4-chloro-3-fluorophenyl)acetamide
CID 60776248
N-(2-chloro-4-iodophenyl)acetamide
CID 18434368
N-(2-acetamidoethyl)-N'-(3,5-dichloro-4-fluorophenyl)oxamide
CID 167889327
N-(4-acetyl-3-chloro-5-methylphenyl)acetamide;1-(4-amino-2-chloro-6-methylphenyl)ethanone
CID 158053967
N-(4-iodophenyl)acetamide
CID 12147
N-[3-chloro-4-(4-propanoylpiperazin-1-yl)phenyl]acetamide
CID 2995453

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dichloro-4-iodophenyl)acetamide?
The IUPAC name of N-(3,5-dichloro-4-iodophenyl)acetamide (CID 156599788) is N-(3,5-dichloro-4-iodophenyl)acetamide.
What is the SMILES notation for N-(3,5-dichloro-4-iodophenyl)acetamide?
The canonical SMILES for N-(3,5-dichloro-4-iodophenyl)acetamide is CC(=O)Nc1cc(Cl)c(I)c(Cl)c1.
What is the InChIKey of N-(3,5-dichloro-4-iodophenyl)acetamide?
The InChIKey is QRSKIQFTCZAYMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6Cl2INO/c1-4(13)12-5-2-6(9)8(11)7(10)3-5/h2-3H,1H3,(H,12,13).
What are the key properties of N-(3,5-dichloro-4-iodophenyl)acetamide?
N-(3,5-dichloro-4-iodophenyl)acetamide has a molecular weight of 329.95 g/mol, XLogP of 3.56, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dichloro-4-iodophenyl)acetamide is sourced from PubChem (CID 156599788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).