N-(2,3-dichlorophenyl)-2-[(4-methylphenyl)methylamino]acetamide

C16H16Cl2N2O — CID 108997146

IUPACN-(2,3-dichlorophenyl)-2-[(4-methylphenyl)methylamino]acetamide
SMILESCc1ccc(CNCC(=O)Nc2cccc(Cl)c2Cl)cc1
InChIInChI=1S/C16H16Cl2N2O/c1-11-5-7-12(8-6-11)9-19-10-15(21)20-14-4-2-3-13(17)16(14)18/h2-8,19H,9-10H2,1H3,(H,20,21)
InChIKeyLVELGZPOZRQCKD-UHFFFAOYSA-N
MW323.22 g/mol
LogP4.03
Rot. Bonds5

About N-(2,3-dichlorophenyl)-2-[(4-methylphenyl)methylamino]acetamide

N-(2,3-dichlorophenyl)-2-[(4-methylphenyl)methylamino]acetamide (PubChem CID 108997146) has the molecular formula C16H16Cl2N2O and a molecular weight of 323.22 g/mol. Its IUPAC name is N-(2,3-dichlorophenyl)-2-[(4-methylphenyl)methylamino]acetamide.

Molecular Properties

Compound NameN-(2,3-dichlorophenyl)-2-[(4-methylphenyl)methylamino]acetamide
PubChem CID108997146
Molecular FormulaC16H16Cl2N2O
Molecular Weight323.22 g/mol
Exact Mass322.06
IUPAC NameN-(2,3-dichlorophenyl)-2-[(4-methylphenyl)methylamino]acetamide
SMILESCc1ccc(CNCC(=O)Nc2cccc(Cl)c2Cl)cc1
InChIInChI=1S/C16H16Cl2N2O/c1-11-5-7-12(8-6-11)9-19-10-15(21)20-14-4-2-3-13(17)16(14)18/h2-8,19H,9-10H2,1H3,(H,20,21)
InChIKeyLVELGZPOZRQCKD-UHFFFAOYSA-N
XLogP4.03
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.22
LogP ≤ 54.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,3-dichlorophenyl)-2-[(4-fluorophenyl)methylamino]acetamide
CID 108997822
N-(2,4-dichlorophenyl)-2-[(4-methylphenyl)methylamino]acetamide
CID 19164034
N-(2,3-dichlorophenyl)-2-[(4-methylphenyl)methylsulfonyl]acetamide
CID 86926204
2-(cyclopropylmethylamino)-N-(2,3-dichlorophenyl)acetamide
CID 60843168
N-(2,3-dichlorophenyl)-2-(hexadecylamino)acetamide
CID 54808960
N-(2,5-dimethylphenyl)-2-[(4-methylphenyl)methylamino]acetamide
CID 108997079
N-[2-(2,3-dichloroanilino)-2-oxoethyl]-2-(3-methylphenyl)acetamide
CID 113001513
N-(2-chlorophenyl)-2-[(4-propan-2-yloxyphenyl)methylamino]acetamide
CID 54845154
4-[[2-(2,3-dichloroanilino)-2-oxoethyl]amino]butanoic acid
CID 43473554
N-[2-(3-chloro-2-methylanilino)-2-oxoethyl]-2-(4-methylphenyl)acetamide
CID 27676992
N-(2,3-dichlorophenyl)-5-[(4-methylphenyl)methylamino]pyrazine-2-carboxamide
CID 109280745
N-(2,3-dichlorophenyl)-1-[(4-methylphenyl)methyl]piperidine-4-carboxamide
CID 45019585

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dichlorophenyl)-2-[(4-methylphenyl)methylamino]acetamide?
The IUPAC name of N-(2,3-dichlorophenyl)-2-[(4-methylphenyl)methylamino]acetamide (CID 108997146) is N-(2,3-dichlorophenyl)-2-[(4-methylphenyl)methylamino]acetamide.
What is the SMILES notation for N-(2,3-dichlorophenyl)-2-[(4-methylphenyl)methylamino]acetamide?
The canonical SMILES for N-(2,3-dichlorophenyl)-2-[(4-methylphenyl)methylamino]acetamide is Cc1ccc(CNCC(=O)Nc2cccc(Cl)c2Cl)cc1.
What is the InChIKey of N-(2,3-dichlorophenyl)-2-[(4-methylphenyl)methylamino]acetamide?
The InChIKey is LVELGZPOZRQCKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16Cl2N2O/c1-11-5-7-12(8-6-11)9-19-10-15(21)20-14-4-2-3-13(17)16(14)18/h2-8,19H,9-10H2,1H3,(H,20,21).
What are the key properties of N-(2,3-dichlorophenyl)-2-[(4-methylphenyl)methylamino]acetamide?
N-(2,3-dichlorophenyl)-2-[(4-methylphenyl)methylamino]acetamide has a molecular weight of 323.22 g/mol, XLogP of 4.03, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dichlorophenyl)-2-[(4-methylphenyl)methylamino]acetamide is sourced from PubChem (CID 108997146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).