N-[3-(2,3-dichlorophenyl)prop-2-enyl]acetamide

C11H11Cl2NO — CID 169464992

IUPACN-[3-(2,3-dichlorophenyl)prop-2-enyl]acetamide
SMILESCC(=O)NCC=Cc1cccc(Cl)c1Cl
InChIInChI=1S/C11H11Cl2NO/c1-8(15)14-7-3-5-9-4-2-6-10(12)11(9)13/h2-6H,7H2,1H3,(H,14,15)
InChIKeyISIXAKSHDFMZQD-UHFFFAOYSA-N
MW244.12 g/mol
LogP3.14
Rot. Bonds3

About N-[3-(2,3-dichlorophenyl)prop-2-enyl]acetamide

N-[3-(2,3-dichlorophenyl)prop-2-enyl]acetamide (PubChem CID 169464992) has the molecular formula C11H11Cl2NO and a molecular weight of 244.12 g/mol. Its IUPAC name is N-[3-(2,3-dichlorophenyl)prop-2-enyl]acetamide.

Molecular Properties

Compound NameN-[3-(2,3-dichlorophenyl)prop-2-enyl]acetamide
PubChem CID169464992
Molecular FormulaC11H11Cl2NO
Molecular Weight244.12 g/mol
Exact Mass243.02
IUPAC NameN-[3-(2,3-dichlorophenyl)prop-2-enyl]acetamide
SMILESCC(=O)NCC=Cc1cccc(Cl)c1Cl
InChIInChI=1S/C11H11Cl2NO/c1-8(15)14-7-3-5-9-4-2-6-10(12)11(9)13/h2-6H,7H2,1H3,(H,14,15)
InChIKeyISIXAKSHDFMZQD-UHFFFAOYSA-N
XLogP3.14
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.12
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-[3-(2,3-dichlorophenyl)prop-2-enyl]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-[3-[2-chloro-3-(trifluoromethyl)phenyl]prop-2-enyl]acetamide
CID 169466678
N-(3-naphthalen-1-ylprop-2-enyl)acetamide
CID 169465612
N-[3-(2-amino-3-methylphenyl)prop-2-enyl]acetamide
CID 169465158
1,7-bis(2,3-dichlorophenyl)hepta-1,6-dien-4-one
CID 141017477
N-[3-(2-chloro-4-hydroxyphenyl)prop-2-enyl]acetamide
CID 169465018
N-[3-(3-fluoro-2-hydroxyphenyl)prop-2-enyl]acetamide
CID 169465029
(E)-4-[[(E)-3-(2,3-dichlorophenyl)prop-2-enoyl]amino]but-2-enoic acid
CID 112746556
3-(3-acetamidoprop-1-enyl)-2-methylbenzoic acid
CID 169465735
N-[3-(2-methoxyphenyl)prop-2-enyl]acetamide
CID 169465048
N-[3-(5-chloro-2-fluorophenyl)prop-2-enyl]acetamide
CID 169464994
N-[3-(4-amino-2,5-dichlorophenyl)prop-2-enyl]acetamide
CID 169465500
N-[3-(1-oxo-2,3-dihydroinden-4-yl)prop-2-enyl]acetamide
CID 169465620

Frequently Asked Questions

What is the IUPAC name of N-[3-(2,3-dichlorophenyl)prop-2-enyl]acetamide?
The IUPAC name of N-[3-(2,3-dichlorophenyl)prop-2-enyl]acetamide (CID 169464992) is N-[3-(2,3-dichlorophenyl)prop-2-enyl]acetamide.
What is the SMILES notation for N-[3-(2,3-dichlorophenyl)prop-2-enyl]acetamide?
The canonical SMILES for N-[3-(2,3-dichlorophenyl)prop-2-enyl]acetamide is CC(=O)NCC=Cc1cccc(Cl)c1Cl.
What is the InChIKey of N-[3-(2,3-dichlorophenyl)prop-2-enyl]acetamide?
The InChIKey is ISIXAKSHDFMZQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11Cl2NO/c1-8(15)14-7-3-5-9-4-2-6-10(12)11(9)13/h2-6H,7H2,1H3,(H,14,15).
What are the key properties of N-[3-(2,3-dichlorophenyl)prop-2-enyl]acetamide?
N-[3-(2,3-dichlorophenyl)prop-2-enyl]acetamide has a molecular weight of 244.12 g/mol, XLogP of 3.14, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2,3-dichlorophenyl)prop-2-enyl]acetamide is sourced from PubChem (CID 169464992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).