2-chloro-N-(4-chlorophenyl)-N-[(4-methylphenyl)methyl]acetamide

C16H15Cl2NO — CID 39443965

IUPAC2-chloro-N-(4-chlorophenyl)-N-[(4-methylphenyl)methyl]acetamide
SMILESCc1ccc(CN(C(=O)CCl)c2ccc(Cl)cc2)cc1
InChIInChI=1S/C16H15Cl2NO/c1-12-2-4-13(5-3-12)11-19(16(20)10-17)15-8-6-14(18)7-9-15/h2-9H,10-11H2,1H3
InChIKeyHJEIVLNJWSEPHF-UHFFFAOYSA-N
MW308.21 g/mol
LogP4.42
Rot. Bonds4

About 2-chloro-N-(4-chlorophenyl)-N-[(4-methylphenyl)methyl]acetamide

2-chloro-N-(4-chlorophenyl)-N-[(4-methylphenyl)methyl]acetamide (PubChem CID 39443965) has the molecular formula C16H15Cl2NO and a molecular weight of 308.21 g/mol. Its IUPAC name is 2-chloro-N-(4-chlorophenyl)-N-[(4-methylphenyl)methyl]acetamide.

Molecular Properties

Compound Name2-chloro-N-(4-chlorophenyl)-N-[(4-methylphenyl)methyl]acetamide
PubChem CID39443965
Molecular FormulaC16H15Cl2NO
Molecular Weight308.21 g/mol
Exact Mass307.05
IUPAC Name2-chloro-N-(4-chlorophenyl)-N-[(4-methylphenyl)methyl]acetamide
SMILESCc1ccc(CN(C(=O)CCl)c2ccc(Cl)cc2)cc1
InChIInChI=1S/C16H15Cl2NO/c1-12-2-4-13(5-3-12)11-19(16(20)10-17)15-8-6-14(18)7-9-15/h2-9H,10-11H2,1H3
InChIKeyHJEIVLNJWSEPHF-UHFFFAOYSA-N
XLogP4.42
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.21
LogP ≤ 54.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-chloro-N-[(3-chlorophenyl)methyl]-N-(4-methylphenyl)acetamide
CID 39443934
N-(4-methylphenyl)-N-[(4-methylphenyl)methyl]propanamide
CID 139238463
2-chloro-N-(4-chlorophenyl)-N-ethylacetamide
CID 15045863
2-chloro-N-[(2-hydroxyphenyl)methyl]-N-(4-methylphenyl)acetamide
CID 86145134
2-chloro-N-methyl-N-[(4-methylphenyl)methyl]acetamide
CID 2450177
2-chloro-N-(3,5-dimethylphenyl)-N-[(4-fluorophenyl)methyl]acetamide
CID 39437129
N-[(4-chlorophenyl)methyl]-2-(dimethylamino)-N-(4-hydroxyphenyl)acetamide
CID 144619641
2-chloro-N-(4-fluorophenyl)-N-[(4-methoxyphenyl)methyl]acetamide
CID 39442873
N-benzyl-2-chloro-N-(4-chloro-2-methylphenyl)acetamide
CID 39443973
2-chloro-N-(2-fluoroethyl)-N-[(4-methylphenyl)methyl]acetamide
CID 166429853
2-amino-N-[(4-chlorophenyl)methyl]-N-phenylacetamide
CID 39373717
2-chloro-N-[(4-chlorophenyl)methyl]-N-methoxyacetamide
CID 166406350

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(4-chlorophenyl)-N-[(4-methylphenyl)methyl]acetamide?
The IUPAC name of 2-chloro-N-(4-chlorophenyl)-N-[(4-methylphenyl)methyl]acetamide (CID 39443965) is 2-chloro-N-(4-chlorophenyl)-N-[(4-methylphenyl)methyl]acetamide.
What is the SMILES notation for 2-chloro-N-(4-chlorophenyl)-N-[(4-methylphenyl)methyl]acetamide?
The canonical SMILES for 2-chloro-N-(4-chlorophenyl)-N-[(4-methylphenyl)methyl]acetamide is Cc1ccc(CN(C(=O)CCl)c2ccc(Cl)cc2)cc1.
What is the InChIKey of 2-chloro-N-(4-chlorophenyl)-N-[(4-methylphenyl)methyl]acetamide?
The InChIKey is HJEIVLNJWSEPHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15Cl2NO/c1-12-2-4-13(5-3-12)11-19(16(20)10-17)15-8-6-14(18)7-9-15/h2-9H,10-11H2,1H3.
What are the key properties of 2-chloro-N-(4-chlorophenyl)-N-[(4-methylphenyl)methyl]acetamide?
2-chloro-N-(4-chlorophenyl)-N-[(4-methylphenyl)methyl]acetamide has a molecular weight of 308.21 g/mol, XLogP of 4.42, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(4-chlorophenyl)-N-[(4-methylphenyl)methyl]acetamide is sourced from PubChem (CID 39443965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).