2-(benzylamino)-N-(2,3-dimethylphenyl)acetamide

C17H20N2O — CID 54813873

IUPAC2-(benzylamino)-N-(2,3-dimethylphenyl)acetamide
SMILESCc1cccc(NC(=O)CNCc2ccccc2)c1C
InChIInChI=1S/C17H20N2O/c1-13-7-6-10-16(14(13)2)19-17(20)12-18-11-15-8-4-3-5-9-15/h3-10,18H,11-12H2,1-2H3,(H,19,20)
InChIKeyLUQJJYREYXIGJO-UHFFFAOYSA-N
MW268.36 g/mol
LogP3.03
Rot. Bonds5

About 2-(benzylamino)-N-(2,3-dimethylphenyl)acetamide

2-(benzylamino)-N-(2,3-dimethylphenyl)acetamide (PubChem CID 54813873) has the molecular formula C17H20N2O and a molecular weight of 268.36 g/mol. Its IUPAC name is 2-(benzylamino)-N-(2,3-dimethylphenyl)acetamide.

Molecular Properties

Compound Name2-(benzylamino)-N-(2,3-dimethylphenyl)acetamide
PubChem CID54813873
Molecular FormulaC17H20N2O
Molecular Weight268.36 g/mol
Exact Mass268.16
IUPAC Name2-(benzylamino)-N-(2,3-dimethylphenyl)acetamide
SMILESCc1cccc(NC(=O)CNCc2ccccc2)c1C
InChIInChI=1S/C17H20N2O/c1-13-7-6-10-16(14(13)2)19-17(20)12-18-11-15-8-4-3-5-9-15/h3-10,18H,11-12H2,1-2H3,(H,19,20)
InChIKeyLUQJJYREYXIGJO-UHFFFAOYSA-N
XLogP3.03
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 53.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(benzylamino)-N-(2-ethylphenyl)acetamide
CID 766717
N-(2,3-dimethylphenyl)-2-(prop-2-ynylamino)acetamide
CID 78908653
N-(2,3-dimethylphenyl)-2-(2-methylpropylamino)acetamide
CID 108993242
N,N'-bis(2,3-dimethylphenyl)butanediamide
CID 4250073
N-(2-benzylphenyl)-2-(2,3-dimethylanilino)acetamide
CID 9080869
N-(2,3-dimethylphenyl)-2-hydroxyacetamide
CID 16769655
1-benzyl-3-(2,3-dimethylphenyl)thiourea
CID 799294
N-benzyl-2,3-dimethylaniline;formic acid
CID 175448541
N'-benzyl-N-(2,3-dimethylphenyl)-N'-methylpropanediamide
CID 108946105
2-[(4-cyanophenyl)methylamino]-N-(2-methylphenyl)acetamide
CID 60918679
2-[[2-(4-benzylpiperazin-1-yl)acetyl]amino]-N-(2,3-dimethylphenyl)acetamide
CID 8902404
N-benzyl-2,3-dimethylaniline;propanoic acid
CID 175448532

Frequently Asked Questions

What is the IUPAC name of 2-(benzylamino)-N-(2,3-dimethylphenyl)acetamide?
The IUPAC name of 2-(benzylamino)-N-(2,3-dimethylphenyl)acetamide (CID 54813873) is 2-(benzylamino)-N-(2,3-dimethylphenyl)acetamide.
What is the SMILES notation for 2-(benzylamino)-N-(2,3-dimethylphenyl)acetamide?
The canonical SMILES for 2-(benzylamino)-N-(2,3-dimethylphenyl)acetamide is Cc1cccc(NC(=O)CNCc2ccccc2)c1C.
What is the InChIKey of 2-(benzylamino)-N-(2,3-dimethylphenyl)acetamide?
The InChIKey is LUQJJYREYXIGJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O/c1-13-7-6-10-16(14(13)2)19-17(20)12-18-11-15-8-4-3-5-9-15/h3-10,18H,11-12H2,1-2H3,(H,19,20).
What are the key properties of 2-(benzylamino)-N-(2,3-dimethylphenyl)acetamide?
2-(benzylamino)-N-(2,3-dimethylphenyl)acetamide has a molecular weight of 268.36 g/mol, XLogP of 3.03, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(benzylamino)-N-(2,3-dimethylphenyl)acetamide is sourced from PubChem (CID 54813873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).