N-(2,4-dichlorophenyl)-N-methylformamide

C8H7Cl2NO — CID 87333606

IUPACN-(2,4-dichlorophenyl)-N-methylformamide
SMILESCN(C=O)c1ccc(Cl)cc1Cl
InChIInChI=1S/C8H7Cl2NO/c1-11(5-12)8-3-2-6(9)4-7(8)10/h2-5H,1H3
InChIKeyLSAOEKNBVHWVAN-UHFFFAOYSA-N
MW204.06 g/mol
LogP2.59
Rot. Bonds2

About N-(2,4-dichlorophenyl)-N-methylformamide

N-(2,4-dichlorophenyl)-N-methylformamide (PubChem CID 87333606) has the molecular formula C8H7Cl2NO and a molecular weight of 204.06 g/mol. Its IUPAC name is N-(2,4-dichlorophenyl)-N-methylformamide.

Molecular Properties

Compound NameN-(2,4-dichlorophenyl)-N-methylformamide
PubChem CID87333606
Molecular FormulaC8H7Cl2NO
Molecular Weight204.06 g/mol
Exact Mass202.99
IUPAC NameN-(2,4-dichlorophenyl)-N-methylformamide
SMILESCN(C=O)c1ccc(Cl)cc1Cl
InChIInChI=1S/C8H7Cl2NO/c1-11(5-12)8-3-2-6(9)4-7(8)10/h2-5H,1H3
InChIKeyLSAOEKNBVHWVAN-UHFFFAOYSA-N
XLogP2.59
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.06
LogP ≤ 52.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze N-(2,4-dichlorophenyl)-N-methylformamide 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-methyl-N-(2,4,6-trichlorophenyl)formamide
CID 87333483
N-(5-chloro-2-propoxyphenyl)-N-methylformamide
CID 146641410
N-[4-(2,4-dichlorobenzoyl)phenyl]-N-methylformamide
CID 43340829
3-amino-N-(2,4-dichlorophenyl)-N-methylpropanamide
CID 28795222
2-(2,4-dichloro-N-methylanilino)acetonitrile
CID 82113638
4,5,9,10-tetrakis(2,4-dichlorophenyl)tricyclo[6.2.0.03,6]decane-2,7-dione
CID 122374961
N-(2,4-dichlorophenyl)-N-propan-2-ylcarbamoyl chloride
CID 56949574
N-(2,4-dichlorophenyl)-2-methylpropanehydrazide
CID 67924615
1-N-(2,4-dichlorophenyl)-1-N,3-dimethylbutane-1,3-diamine
CID 115200543
1,4-dichlorobenzene;formyl chloride
CID 174264230
3-cyano-N-(2,4-dichlorophenyl)-N-methylpropanamide
CID 115173703
N-methyl-N-[4-methyl-2-(methylamino)phenyl]formamide
CID 142044757

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dichlorophenyl)-N-methylformamide?
The IUPAC name of N-(2,4-dichlorophenyl)-N-methylformamide (CID 87333606) is N-(2,4-dichlorophenyl)-N-methylformamide.
What is the SMILES notation for N-(2,4-dichlorophenyl)-N-methylformamide?
The canonical SMILES for N-(2,4-dichlorophenyl)-N-methylformamide is CN(C=O)c1ccc(Cl)cc1Cl.
What is the InChIKey of N-(2,4-dichlorophenyl)-N-methylformamide?
The InChIKey is LSAOEKNBVHWVAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7Cl2NO/c1-11(5-12)8-3-2-6(9)4-7(8)10/h2-5H,1H3.
What are the key properties of N-(2,4-dichlorophenyl)-N-methylformamide?
N-(2,4-dichlorophenyl)-N-methylformamide has a molecular weight of 204.06 g/mol, XLogP of 2.59, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dichlorophenyl)-N-methylformamide is sourced from PubChem (CID 87333606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).