N-methyl-N-phenyl-2-(N,2,3-trimethylanilino)acetamide

C18H22N2O — CID 60525145

IUPACN-methyl-N-phenyl-2-(N,2,3-trimethylanilino)acetamide
SMILESCc1cccc(N(C)CC(=O)N(C)c2ccccc2)c1C
InChIInChI=1S/C18H22N2O/c1-14-9-8-12-17(15(14)2)19(3)13-18(21)20(4)16-10-6-5-7-11-16/h5-12H,13H2,1-4H3
InChIKeyKHNCBDACHNIECM-UHFFFAOYSA-N
MW282.39 g/mol
LogP3.40
Rot. Bonds4

About N-methyl-N-phenyl-2-(N,2,3-trimethylanilino)acetamide

N-methyl-N-phenyl-2-(N,2,3-trimethylanilino)acetamide (PubChem CID 60525145) has the molecular formula C18H22N2O and a molecular weight of 282.39 g/mol. Its IUPAC name is N-methyl-N-phenyl-2-(N,2,3-trimethylanilino)acetamide.

Molecular Properties

Compound NameN-methyl-N-phenyl-2-(N,2,3-trimethylanilino)acetamide
PubChem CID60525145
Molecular FormulaC18H22N2O
Molecular Weight282.39 g/mol
Exact Mass282.17
IUPAC NameN-methyl-N-phenyl-2-(N,2,3-trimethylanilino)acetamide
SMILESCc1cccc(N(C)CC(=O)N(C)c2ccccc2)c1C
InChIInChI=1S/C18H22N2O/c1-14-9-8-12-17(15(14)2)19(3)13-18(21)20(4)16-10-6-5-7-11-16/h5-12H,13H2,1-4H3
InChIKeyKHNCBDACHNIECM-UHFFFAOYSA-N
XLogP3.40
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 53.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-bromo-N-(2,3-dimethylphenyl)-N-methylacetamide
CID 10682477
2-[methyl-[2-(N-methylanilino)-2-oxoethyl]amino]acetic acid
CID 43442375
2-(dimethylamino)-N-methyl-N-(2-methylphenyl)acetamide
CID 21343400
N-(2,3-dimethylphenyl)-N-phenylhydroxylamine
CID 141495337
N-methyl-N-phenyl-2-pyrrol-1-ylacetamide
CID 110688597
3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-N-methyl-N-phenylpropanamide
CID 109029653
N-methyl-2-[methyl-[3-(2-methylphenoxy)propyl]amino]-N-phenylacetamide
CID 52679743
2-[bis(2-chloroethyl)amino]-N-methyl-N-phenylacetamide
CID 15344
2-methyl-2-[methyl-[2-(N-methylanilino)-2-oxoethyl]amino]propanoic acid
CID 62822694
3-hydroxy-N-methyl-N-phenylpropanamide
CID 82111467
[3-(N-carboxy-2,3-dimethylanilino)-2-methylphenyl]-(2,3-dimethylphenyl)carbamic acid
CID 174980910
N-(3-acetylphenyl)-2-(N,2,3-trimethylanilino)acetamide
CID 52689391

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-phenyl-2-(N,2,3-trimethylanilino)acetamide?
The IUPAC name of N-methyl-N-phenyl-2-(N,2,3-trimethylanilino)acetamide (CID 60525145) is N-methyl-N-phenyl-2-(N,2,3-trimethylanilino)acetamide.
What is the SMILES notation for N-methyl-N-phenyl-2-(N,2,3-trimethylanilino)acetamide?
The canonical SMILES for N-methyl-N-phenyl-2-(N,2,3-trimethylanilino)acetamide is Cc1cccc(N(C)CC(=O)N(C)c2ccccc2)c1C.
What is the InChIKey of N-methyl-N-phenyl-2-(N,2,3-trimethylanilino)acetamide?
The InChIKey is KHNCBDACHNIECM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O/c1-14-9-8-12-17(15(14)2)19(3)13-18(21)20(4)16-10-6-5-7-11-16/h5-12H,13H2,1-4H3.
What are the key properties of N-methyl-N-phenyl-2-(N,2,3-trimethylanilino)acetamide?
N-methyl-N-phenyl-2-(N,2,3-trimethylanilino)acetamide has a molecular weight of 282.39 g/mol, XLogP of 3.40, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-phenyl-2-(N,2,3-trimethylanilino)acetamide is sourced from PubChem (CID 60525145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).