N-[(2-chlorophenyl)methyl]-2-(2,6-dichlorophenyl)acetamide

C15H12Cl3NO — CID 2679601

IUPACN-[(2-chlorophenyl)methyl]-2-(2,6-dichlorophenyl)acetamide
SMILESO=C(Cc1c(Cl)cccc1Cl)NCc1ccccc1Cl
InChIInChI=1S/C15H12Cl3NO/c16-12-5-2-1-4-10(12)9-19-15(20)8-11-13(17)6-3-7-14(11)18/h1-7H,8-9H2,(H,19,20)
InChIKeyNRXZCBCOPCSDCZ-UHFFFAOYSA-N
MW328.63 g/mol
LogP4.51
Rot. Bonds4

About N-[(2-chlorophenyl)methyl]-2-(2,6-dichlorophenyl)acetamide

N-[(2-chlorophenyl)methyl]-2-(2,6-dichlorophenyl)acetamide (PubChem CID 2679601) has the molecular formula C15H12Cl3NO and a molecular weight of 328.63 g/mol. Its IUPAC name is N-[(2-chlorophenyl)methyl]-2-(2,6-dichlorophenyl)acetamide.

Molecular Properties

Compound NameN-[(2-chlorophenyl)methyl]-2-(2,6-dichlorophenyl)acetamide
PubChem CID2679601
Molecular FormulaC15H12Cl3NO
Molecular Weight328.63 g/mol
Exact Mass327.00
IUPAC NameN-[(2-chlorophenyl)methyl]-2-(2,6-dichlorophenyl)acetamide
SMILESO=C(Cc1c(Cl)cccc1Cl)NCc1ccccc1Cl
InChIInChI=1S/C15H12Cl3NO/c16-12-5-2-1-4-10(12)9-19-15(20)8-11-13(17)6-3-7-14(11)18/h1-7H,8-9H2,(H,19,20)
InChIKeyNRXZCBCOPCSDCZ-UHFFFAOYSA-N
XLogP4.51
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.63
LogP ≤ 54.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-chloro-N-[(2-chlorophenyl)methyl]propanamide
CID 17126907
N-benzyl-N'-[(2-chlorophenyl)methyl]propanediamide
CID 108945203
N-[(2-chlorophenyl)methyl]-4-oxopentanamide
CID 60636911
N-[(2-chlorophenyl)methyl]-3-oxo-3-phenylpropanamide
CID 619799
2-(2,6-dichlorophenyl)-N-(furan-2-ylmethyl)acetamide
CID 2082030
N-[(2-chlorophenyl)methyl]-2-(1H-pyrrol-2-yl)acetamide
CID 110690809
N-[(2-chlorophenyl)methyl]-2-quinolin-8-ylacetamide
CID 51307001
N-(2-chloroprop-2-enyl)-2-(2,6-dichlorophenyl)acetamide
CID 115636770
4-amino-N-[(2-chlorophenyl)methyl]butanamide
CID 22692149
N-[(2-chlorophenyl)methyl]-N'-(2,3-dichlorophenyl)propanediamide
CID 108946674
2-(1-benzothiophen-3-yl)-N-[(2-chlorophenyl)methyl]acetamide
CID 46261254
N-[(2-chlorophenyl)methyl]-2-(3,4-dimethylphenyl)acetamide
CID 2679540

Frequently Asked Questions

What is the IUPAC name of N-[(2-chlorophenyl)methyl]-2-(2,6-dichlorophenyl)acetamide?
The IUPAC name of N-[(2-chlorophenyl)methyl]-2-(2,6-dichlorophenyl)acetamide (CID 2679601) is N-[(2-chlorophenyl)methyl]-2-(2,6-dichlorophenyl)acetamide.
What is the SMILES notation for N-[(2-chlorophenyl)methyl]-2-(2,6-dichlorophenyl)acetamide?
The canonical SMILES for N-[(2-chlorophenyl)methyl]-2-(2,6-dichlorophenyl)acetamide is O=C(Cc1c(Cl)cccc1Cl)NCc1ccccc1Cl.
What is the InChIKey of N-[(2-chlorophenyl)methyl]-2-(2,6-dichlorophenyl)acetamide?
The InChIKey is NRXZCBCOPCSDCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12Cl3NO/c16-12-5-2-1-4-10(12)9-19-15(20)8-11-13(17)6-3-7-14(11)18/h1-7H,8-9H2,(H,19,20).
What are the key properties of N-[(2-chlorophenyl)methyl]-2-(2,6-dichlorophenyl)acetamide?
N-[(2-chlorophenyl)methyl]-2-(2,6-dichlorophenyl)acetamide has a molecular weight of 328.63 g/mol, XLogP of 4.51, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-chlorophenyl)methyl]-2-(2,6-dichlorophenyl)acetamide is sourced from PubChem (CID 2679601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).