N-(2-bromoprop-2-enyl)-2-(2-chloro-6-fluorophenyl)acetamide

C11H10BrClFNO — CID 115594615

IUPACN-(2-bromoprop-2-enyl)-2-(2-chloro-6-fluorophenyl)acetamide
SMILESC=C(Br)CNC(=O)Cc1c(F)cccc1Cl
InChIInChI=1S/C11H10BrClFNO/c1-7(12)6-15-11(16)5-8-9(13)3-2-4-10(8)14/h2-4H,1,5-6H2,(H,15,16)
InChIKeyLZQRNWKALGDHSJ-UHFFFAOYSA-N
MW306.56 g/mol
LogP3.05
Rot. Bonds4

About N-(2-bromoprop-2-enyl)-2-(2-chloro-6-fluorophenyl)acetamide

N-(2-bromoprop-2-enyl)-2-(2-chloro-6-fluorophenyl)acetamide (PubChem CID 115594615) has the molecular formula C11H10BrClFNO and a molecular weight of 306.56 g/mol. Its IUPAC name is N-(2-bromoprop-2-enyl)-2-(2-chloro-6-fluorophenyl)acetamide.

Molecular Properties

Compound NameN-(2-bromoprop-2-enyl)-2-(2-chloro-6-fluorophenyl)acetamide
PubChem CID115594615
Molecular FormulaC11H10BrClFNO
Molecular Weight306.56 g/mol
Exact Mass304.96
IUPAC NameN-(2-bromoprop-2-enyl)-2-(2-chloro-6-fluorophenyl)acetamide
SMILESC=C(Br)CNC(=O)Cc1c(F)cccc1Cl
InChIInChI=1S/C11H10BrClFNO/c1-7(12)6-15-11(16)5-8-9(13)3-2-4-10(8)14/h2-4H,1,5-6H2,(H,15,16)
InChIKeyLZQRNWKALGDHSJ-UHFFFAOYSA-N
XLogP3.05
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.56
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-(2-bromoprop-2-enyl)-2-(2-chloro-6-fluorophenyl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-bromoprop-2-enyl)-2-(2,3-difluorophenyl)acetamide
CID 115686682
N-(2-chloroprop-2-enyl)-2-(2,6-dichlorophenyl)acetamide
CID 115636770
N-(2-amino-2-methylpropyl)-2-(2-chloro-6-fluorophenyl)acetamide
CID 81483240
2-(2,6-difluorophenyl)-N-(2-methylprop-2-enyl)acetamide
CID 114618657
2-(2-chloro-6-fluorophenyl)-N-(furan-2-ylmethyl)acetamide
CID 2161159
benzyl 2-[[2-(2-chloro-6-fluorophenyl)acetyl]amino]acetate
CID 7980436
2-(2-chloro-6-fluorophenyl)-N-(3,3-difluoro-2-hydroxypropyl)acetamide
CID 113258587
2-(2-chloro-6-fluorophenyl)-N-[[4-(chloromethyl)phenyl]methyl]acetamide
CID 107233350
2-(2-chloro-6-fluorophenyl)-N-(5-iodopentyl)acetamide
CID 107322545
2-[[2-(2-chloro-6-fluorophenyl)acetyl]amino]-2-oxoacetic acid
CID 2780091
2-(2-chloro-6-fluorophenyl)-N-(4-chlorophenyl)acetamide
CID 9413330
N'-acetyl-2-(2-chloro-6-fluorophenyl)acetohydrazide
CID 30905798

Frequently Asked Questions

What is the IUPAC name of N-(2-bromoprop-2-enyl)-2-(2-chloro-6-fluorophenyl)acetamide?
The IUPAC name of N-(2-bromoprop-2-enyl)-2-(2-chloro-6-fluorophenyl)acetamide (CID 115594615) is N-(2-bromoprop-2-enyl)-2-(2-chloro-6-fluorophenyl)acetamide.
What is the SMILES notation for N-(2-bromoprop-2-enyl)-2-(2-chloro-6-fluorophenyl)acetamide?
The canonical SMILES for N-(2-bromoprop-2-enyl)-2-(2-chloro-6-fluorophenyl)acetamide is C=C(Br)CNC(=O)Cc1c(F)cccc1Cl.
What is the InChIKey of N-(2-bromoprop-2-enyl)-2-(2-chloro-6-fluorophenyl)acetamide?
The InChIKey is LZQRNWKALGDHSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10BrClFNO/c1-7(12)6-15-11(16)5-8-9(13)3-2-4-10(8)14/h2-4H,1,5-6H2,(H,15,16).
What are the key properties of N-(2-bromoprop-2-enyl)-2-(2-chloro-6-fluorophenyl)acetamide?
N-(2-bromoprop-2-enyl)-2-(2-chloro-6-fluorophenyl)acetamide has a molecular weight of 306.56 g/mol, XLogP of 3.05, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromoprop-2-enyl)-2-(2-chloro-6-fluorophenyl)acetamide is sourced from PubChem (CID 115594615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).