N-(2,2-dichloroethenyl)benzamide

C9H7Cl2NO — CID 2131512

IUPACN-(2,2-dichloroethenyl)benzamide
SMILESO=C(NC=C(Cl)Cl)c1ccccc1
InChIInChI=1S/C9H7Cl2NO/c10-8(11)6-12-9(13)7-4-2-1-3-5-7/h1-6H,(H,12,13)
InChIKeyKPHFIGBUDFKPJW-UHFFFAOYSA-N
MW216.07 g/mol
LogP2.69
Rot. Bonds2

About N-(2,2-dichloroethenyl)benzamide

N-(2,2-dichloroethenyl)benzamide (PubChem CID 2131512) has the molecular formula C9H7Cl2NO and a molecular weight of 216.07 g/mol. Its IUPAC name is N-(2,2-dichloroethenyl)benzamide.

Molecular Properties

Compound NameN-(2,2-dichloroethenyl)benzamide
PubChem CID2131512
Molecular FormulaC9H7Cl2NO
Molecular Weight216.07 g/mol
Exact Mass214.99
IUPAC NameN-(2,2-dichloroethenyl)benzamide
SMILESO=C(NC=C(Cl)Cl)c1ccccc1
InChIInChI=1S/C9H7Cl2NO/c10-8(11)6-12-9(13)7-4-2-1-3-5-7/h1-6H,(H,12,13)
InChIKeyKPHFIGBUDFKPJW-UHFFFAOYSA-N
XLogP2.69
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.07
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(2,2-dichloroethenyl)benzamide;dihydroxy(oxo)phosphanium
CID 174677008
N-(2,2-dichloroethenyl)-4-methylbenzamide
CID 651612
N-(2-cyano-2-phenylethenyl)benzamide
CID 570201
N-[(Z)-3-amino-2-methyl-3-oxoprop-1-enyl]benzamide
CID 11846933
N-(2,2-dichloroethenyl)-2-methoxybenzamide
CID 12837648
N-[(Z)-3-oxo-3-phenylprop-1-enyl]benzamide
CID 102308068
N-(4,4-dichloro-2-methylbut-3-en-2-yl)benzamide
CID 88654986
N-[(Z)-2-methoxyethenyl]benzamide
CID 92959913
N-[(Z)-3-amino-3-oxoprop-1-enyl]benzamide
CID 102327969
N-[(1Z,3E)-2-ethylhexa-1,3-dienyl]benzamide
CID 101347654
N-[2-(4-chlorophenyl)ethenyl]benzamide
CID 76527848
N-(3,3-dimethylbut-1-enyl)benzamide
CID 134831914

Frequently Asked Questions

What is the IUPAC name of N-(2,2-dichloroethenyl)benzamide?
The IUPAC name of N-(2,2-dichloroethenyl)benzamide (CID 2131512) is N-(2,2-dichloroethenyl)benzamide.
What is the SMILES notation for N-(2,2-dichloroethenyl)benzamide?
The canonical SMILES for N-(2,2-dichloroethenyl)benzamide is O=C(NC=C(Cl)Cl)c1ccccc1.
What is the InChIKey of N-(2,2-dichloroethenyl)benzamide?
The InChIKey is KPHFIGBUDFKPJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7Cl2NO/c10-8(11)6-12-9(13)7-4-2-1-3-5-7/h1-6H,(H,12,13).
What are the key properties of N-(2,2-dichloroethenyl)benzamide?
N-(2,2-dichloroethenyl)benzamide has a molecular weight of 216.07 g/mol, XLogP of 2.69, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dichloroethenyl)benzamide is sourced from PubChem (CID 2131512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).