N-methyl-2-[2-methyl-N-[(2-methylphenyl)methyl]anilino]acetamide

C18H22N2O — CID 47092405

IUPACN-methyl-2-[2-methyl-N-[(2-methylphenyl)methyl]anilino]acetamide
SMILESCNC(=O)CN(Cc1ccccc1C)c1ccccc1C
InChIInChI=1S/C18H22N2O/c1-14-8-4-6-10-16(14)12-20(13-18(21)19-3)17-11-7-5-9-15(17)2/h4-11H,12-13H2,1-3H3,(H,19,21)
InChIKeyWEJXCJFEYCECRN-UHFFFAOYSA-N
MW282.39 g/mol
LogP3.06
Rot. Bonds5

About N-methyl-2-[2-methyl-N-[(2-methylphenyl)methyl]anilino]acetamide

N-methyl-2-[2-methyl-N-[(2-methylphenyl)methyl]anilino]acetamide (PubChem CID 47092405) has the molecular formula C18H22N2O and a molecular weight of 282.39 g/mol. Its IUPAC name is N-methyl-2-[2-methyl-N-[(2-methylphenyl)methyl]anilino]acetamide.

Molecular Properties

Compound NameN-methyl-2-[2-methyl-N-[(2-methylphenyl)methyl]anilino]acetamide
PubChem CID47092405
Molecular FormulaC18H22N2O
Molecular Weight282.39 g/mol
Exact Mass282.17
IUPAC NameN-methyl-2-[2-methyl-N-[(2-methylphenyl)methyl]anilino]acetamide
SMILESCNC(=O)CN(Cc1ccccc1C)c1ccccc1C
InChIInChI=1S/C18H22N2O/c1-14-8-4-6-10-16(14)12-20(13-18(21)19-3)17-11-7-5-9-15(17)2/h4-11H,12-13H2,1-3H3,(H,19,21)
InChIKeyWEJXCJFEYCECRN-UHFFFAOYSA-N
XLogP3.06
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

methyl 2-[(N-(2-methoxy-2-oxoethyl)-2-methylanilino)methyl]benzoate
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2-[(2-aminophenyl)methyl-methylamino]-N-methylacetamide
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2-[N-ethyl-2-[(2-methylpropylamino)methyl]anilino]-N-methylacetamide
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N-(2,6-diethylphenyl)-2-[methyl-[(2-methylphenyl)methyl]amino]acetamide
CID 8964124
1-(N-benzyl-2-methylanilino)propan-2-one
CID 21318921
N-butyl-2-[methyl-[(2-methylphenyl)methyl]amino]acetamide
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methyl 3-[(N-ethyl-2-methylanilino)methyl]furan-2-carboxylate
CID 78902588
N-methyl-4-(2-methylphenyl)butanamide
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CID 120703807

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[2-methyl-N-[(2-methylphenyl)methyl]anilino]acetamide?
The IUPAC name of N-methyl-2-[2-methyl-N-[(2-methylphenyl)methyl]anilino]acetamide (CID 47092405) is N-methyl-2-[2-methyl-N-[(2-methylphenyl)methyl]anilino]acetamide.
What is the SMILES notation for N-methyl-2-[2-methyl-N-[(2-methylphenyl)methyl]anilino]acetamide?
The canonical SMILES for N-methyl-2-[2-methyl-N-[(2-methylphenyl)methyl]anilino]acetamide is CNC(=O)CN(Cc1ccccc1C)c1ccccc1C.
What is the InChIKey of N-methyl-2-[2-methyl-N-[(2-methylphenyl)methyl]anilino]acetamide?
The InChIKey is WEJXCJFEYCECRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O/c1-14-8-4-6-10-16(14)12-20(13-18(21)19-3)17-11-7-5-9-15(17)2/h4-11H,12-13H2,1-3H3,(H,19,21).
What are the key properties of N-methyl-2-[2-methyl-N-[(2-methylphenyl)methyl]anilino]acetamide?
N-methyl-2-[2-methyl-N-[(2-methylphenyl)methyl]anilino]acetamide has a molecular weight of 282.39 g/mol, XLogP of 3.06, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[2-methyl-N-[(2-methylphenyl)methyl]anilino]acetamide is sourced from PubChem (CID 47092405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).