N-(3-amino-2,2-difluoropropyl)-2-iodobenzamide

C10H11F2IN2O — CID 114383668

IUPACN-(3-amino-2,2-difluoropropyl)-2-iodobenzamide
SMILESNCC(F)(F)CNC(=O)c1ccccc1I
InChIInChI=1S/C10H11F2IN2O/c11-10(12,5-14)6-15-9(16)7-3-1-2-4-8(7)13/h1-4H,5-6,14H2,(H,15,16)
InChIKeyNZFLHVJMCFREER-UHFFFAOYSA-N
MW340.11 g/mol
LogP1.62
Rot. Bonds4

About N-(3-amino-2,2-difluoropropyl)-2-iodobenzamide

N-(3-amino-2,2-difluoropropyl)-2-iodobenzamide (PubChem CID 114383668) has the molecular formula C10H11F2IN2O and a molecular weight of 340.11 g/mol. Its IUPAC name is N-(3-amino-2,2-difluoropropyl)-2-iodobenzamide.

Molecular Properties

Compound NameN-(3-amino-2,2-difluoropropyl)-2-iodobenzamide
PubChem CID114383668
Molecular FormulaC10H11F2IN2O
Molecular Weight340.11 g/mol
Exact Mass339.99
IUPAC NameN-(3-amino-2,2-difluoropropyl)-2-iodobenzamide
SMILESNCC(F)(F)CNC(=O)c1ccccc1I
InChIInChI=1S/C10H11F2IN2O/c11-10(12,5-14)6-15-9(16)7-3-1-2-4-8(7)13/h1-4H,5-6,14H2,(H,15,16)
InChIKeyNZFLHVJMCFREER-UHFFFAOYSA-N
XLogP1.62
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.11
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(3-amino-2,2-difluoropropyl)-2-hydroxybenzamide
CID 114383534
2-amino-N-(3-amino-2,2-difluoropropyl)benzamide
CID 122081037
N-(3-amino-2,2-difluoropropyl)-2,3-dihydroxybenzamide
CID 114383835
N-(3-amino-2,2-difluoropropyl)-2-oxo-1H-pyridine-3-carboxamide
CID 114383719
N-(3-amino-2,2-difluoropropyl)-3-bromo-2-fluorobenzamide
CID 107956309
2-iodo-N-[[2-(trifluoromethyl)phenyl]methyl]benzamide
CID 60738967
N-(3-amino-2,2-difluoropropyl)-2-methylquinoline-4-carboxamide
CID 114383383
N-(3-amino-2,2-difluoropropyl)-2-chloro-6-fluorobenzamide
CID 114383783
N-(3-amino-2,2-difluoropropyl)-3-fluoropyridine-4-carboxamide
CID 114383432
N-(2-hydroxy-2,4-dimethylpentyl)-2-iodobenzamide
CID 66178734
2-hydroxy-N-[2-[(2-iodobenzoyl)amino]ethyl]benzamide
CID 108539161
N-(3-amino-2,2-difluoropropyl)-4-chlorobenzamide
CID 114383666

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-2,2-difluoropropyl)-2-iodobenzamide?
The IUPAC name of N-(3-amino-2,2-difluoropropyl)-2-iodobenzamide (CID 114383668) is N-(3-amino-2,2-difluoropropyl)-2-iodobenzamide.
What is the SMILES notation for N-(3-amino-2,2-difluoropropyl)-2-iodobenzamide?
The canonical SMILES for N-(3-amino-2,2-difluoropropyl)-2-iodobenzamide is NCC(F)(F)CNC(=O)c1ccccc1I.
What is the InChIKey of N-(3-amino-2,2-difluoropropyl)-2-iodobenzamide?
The InChIKey is NZFLHVJMCFREER-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11F2IN2O/c11-10(12,5-14)6-15-9(16)7-3-1-2-4-8(7)13/h1-4H,5-6,14H2,(H,15,16).
What are the key properties of N-(3-amino-2,2-difluoropropyl)-2-iodobenzamide?
N-(3-amino-2,2-difluoropropyl)-2-iodobenzamide has a molecular weight of 340.11 g/mol, XLogP of 1.62, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-2,2-difluoropropyl)-2-iodobenzamide is sourced from PubChem (CID 114383668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).