N-dichlorophosphoryl-4-iodobenzamide

C7H5Cl2INO2P — CID 165356535

IUPACN-dichlorophosphoryl-4-iodobenzamide
SMILESO=C(NP(=O)(Cl)Cl)c1ccc(I)cc1
InChIInChI=1S/C7H5Cl2INO2P/c8-14(9,13)11-7(12)5-1-3-6(10)4-2-5/h1-4H,(H,11,12,13)
InChIKeyDDARNMDASMELCX-UHFFFAOYSA-N
MW363.91 g/mol
LogP3.61
Rot. Bonds2

About N-dichlorophosphoryl-4-iodobenzamide

N-dichlorophosphoryl-4-iodobenzamide (PubChem CID 165356535) has the molecular formula C7H5Cl2INO2P and a molecular weight of 363.91 g/mol. Its IUPAC name is N-dichlorophosphoryl-4-iodobenzamide.

Molecular Properties

Compound NameN-dichlorophosphoryl-4-iodobenzamide
PubChem CID165356535
Molecular FormulaC7H5Cl2INO2P
Molecular Weight363.91 g/mol
Exact Mass362.85
IUPAC NameN-dichlorophosphoryl-4-iodobenzamide
SMILESO=C(NP(=O)(Cl)Cl)c1ccc(I)cc1
InChIInChI=1S/C7H5Cl2INO2P/c8-14(9,13)11-7(12)5-1-3-6(10)4-2-5/h1-4H,(H,11,12,13)
InChIKeyDDARNMDASMELCX-UHFFFAOYSA-N
XLogP3.61
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.91
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-iodo-N-[(4-iodobenzoyl)amino]oxybenzamide
CID 87933857
4-iodo-N-[4-[(4-iodobenzoyl)amino]phenyl]benzamide
CID 4105689
bis[4-(4-iodobenzoyl)phenyl]methanone
CID 22494471
1,3-bis(4-iodophenyl)propane-1,3-dione
CID 15256965
4-iodo-N-(2,4,6-triiodophenyl)benzamide
CID 63525460
N-(2-amino-2-oxoethyl)-4-iodobenzamide
CID 60668486
4-iodo-N-(2,3,4,5,6-pentafluorophenyl)benzamide
CID 78909417
4-iodo-N-pyrrol-1-ylbenzamide
CID 79107507
4-iodo-N-(3-iodopropyl)benzamide
CID 114504016
4-iodobenzoic acid;nickel
CID 54603201
2-fluoro-1-(4-iodophenyl)ethanone
CID 87150711
4-[(4-iodobenzoyl)amino]benzenesulfonyl chloride
CID 43124844

Frequently Asked Questions

What is the IUPAC name of N-dichlorophosphoryl-4-iodobenzamide?
The IUPAC name of N-dichlorophosphoryl-4-iodobenzamide (CID 165356535) is N-dichlorophosphoryl-4-iodobenzamide.
What is the SMILES notation for N-dichlorophosphoryl-4-iodobenzamide?
The canonical SMILES for N-dichlorophosphoryl-4-iodobenzamide is O=C(NP(=O)(Cl)Cl)c1ccc(I)cc1.
What is the InChIKey of N-dichlorophosphoryl-4-iodobenzamide?
The InChIKey is DDARNMDASMELCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5Cl2INO2P/c8-14(9,13)11-7(12)5-1-3-6(10)4-2-5/h1-4H,(H,11,12,13).
What are the key properties of N-dichlorophosphoryl-4-iodobenzamide?
N-dichlorophosphoryl-4-iodobenzamide has a molecular weight of 363.91 g/mol, XLogP of 3.61, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-dichlorophosphoryl-4-iodobenzamide is sourced from PubChem (CID 165356535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).