N-[(3-methylphenyl)methyl]-2-(2,4,6-trimethylanilino)acetamide

C19H24N2O — CID 108996939

IUPACN-[(3-methylphenyl)methyl]-2-(2,4,6-trimethylanilino)acetamide
SMILESCc1cccc(CNC(=O)CNc2c(C)cc(C)cc2C)c1
InChIInChI=1S/C19H24N2O/c1-13-6-5-7-17(10-13)11-20-18(22)12-21-19-15(3)8-14(2)9-16(19)4/h5-10,21H,11-12H2,1-4H3,(H,20,22)
InChIKeyJAKOKLVBLZSRGL-UHFFFAOYSA-N
MW296.41 g/mol
LogP3.65
Rot. Bonds5

About N-[(3-methylphenyl)methyl]-2-(2,4,6-trimethylanilino)acetamide

N-[(3-methylphenyl)methyl]-2-(2,4,6-trimethylanilino)acetamide (PubChem CID 108996939) has the molecular formula C19H24N2O and a molecular weight of 296.41 g/mol. Its IUPAC name is N-[(3-methylphenyl)methyl]-2-(2,4,6-trimethylanilino)acetamide.

Molecular Properties

Compound NameN-[(3-methylphenyl)methyl]-2-(2,4,6-trimethylanilino)acetamide
PubChem CID108996939
Molecular FormulaC19H24N2O
Molecular Weight296.41 g/mol
Exact Mass296.19
IUPAC NameN-[(3-methylphenyl)methyl]-2-(2,4,6-trimethylanilino)acetamide
SMILESCc1cccc(CNC(=O)CNc2c(C)cc(C)cc2C)c1
InChIInChI=1S/C19H24N2O/c1-13-6-5-7-17(10-13)11-20-18(22)12-21-19-15(3)8-14(2)9-16(19)4/h5-10,21H,11-12H2,1-4H3,(H,20,22)
InChIKeyJAKOKLVBLZSRGL-UHFFFAOYSA-N
XLogP3.65
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.41
LogP ≤ 53.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-ethyl-6-methylanilino)-N-[(3-methylphenyl)methyl]acetamide
CID 108996936
2-(methylamino)-N-[(3-methylphenyl)methyl]acetamide
CID 60913954
N-[(3-methylphenyl)methyl]-N'-(2,4,6-trimethylphenyl)oxamide
CID 108984747
N-[(4-methoxyphenyl)methyl]-2-(2,4,6-trimethylanilino)acetamide
CID 54812010
2-(4-acetamidoanilino)-N-[(3-methylphenyl)methyl]acetamide
CID 108996973
N'-(2-chloro-4,6-dimethylphenyl)-N-[(3-methylphenyl)methyl]propanediamide
CID 108945626
2-(cyclopropylmethylamino)-N-[(3-methylphenyl)methyl]acetamide
CID 60915187
2-(3,4-difluoroanilino)-N-[(3-methylphenyl)methyl]acetamide
CID 108997018
2-bromo-N-[(3-methylphenyl)methyl]acetamide
CID 63679307
2-fluoro-N-[(3-methylphenyl)methyl]acetamide
CID 130011767
2-methyl-N-[2-[(3-methylphenyl)methylamino]-2-oxoethyl]benzamide
CID 112992155
N-ethyl-2-(2,4,6-trimethylanilino)acetamide
CID 54812059

Frequently Asked Questions

What is the IUPAC name of N-[(3-methylphenyl)methyl]-2-(2,4,6-trimethylanilino)acetamide?
The IUPAC name of N-[(3-methylphenyl)methyl]-2-(2,4,6-trimethylanilino)acetamide (CID 108996939) is N-[(3-methylphenyl)methyl]-2-(2,4,6-trimethylanilino)acetamide.
What is the SMILES notation for N-[(3-methylphenyl)methyl]-2-(2,4,6-trimethylanilino)acetamide?
The canonical SMILES for N-[(3-methylphenyl)methyl]-2-(2,4,6-trimethylanilino)acetamide is Cc1cccc(CNC(=O)CNc2c(C)cc(C)cc2C)c1.
What is the InChIKey of N-[(3-methylphenyl)methyl]-2-(2,4,6-trimethylanilino)acetamide?
The InChIKey is JAKOKLVBLZSRGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O/c1-13-6-5-7-17(10-13)11-20-18(22)12-21-19-15(3)8-14(2)9-16(19)4/h5-10,21H,11-12H2,1-4H3,(H,20,22).
What are the key properties of N-[(3-methylphenyl)methyl]-2-(2,4,6-trimethylanilino)acetamide?
N-[(3-methylphenyl)methyl]-2-(2,4,6-trimethylanilino)acetamide has a molecular weight of 296.41 g/mol, XLogP of 3.65, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-methylphenyl)methyl]-2-(2,4,6-trimethylanilino)acetamide is sourced from PubChem (CID 108996939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).