N-(2-methoxy-5-methylphenyl)-N-methyl-2-(methylamino)acetamide

C12H18N2O2 — CID 82494481

IUPACN-(2-methoxy-5-methylphenyl)-N-methyl-2-(methylamino)acetamide
SMILESCNCC(=O)N(C)c1cc(C)ccc1OC
InChIInChI=1S/C12H18N2O2/c1-9-5-6-11(16-4)10(7-9)14(3)12(15)8-13-2/h5-7,13H,8H2,1-4H3
InChIKeyWCGNKEKMXSQNTR-UHFFFAOYSA-N
MW222.29 g/mol
LogP1.19
Rot. Bonds4

About N-(2-methoxy-5-methylphenyl)-N-methyl-2-(methylamino)acetamide

N-(2-methoxy-5-methylphenyl)-N-methyl-2-(methylamino)acetamide (PubChem CID 82494481) has the molecular formula C12H18N2O2 and a molecular weight of 222.29 g/mol. Its IUPAC name is N-(2-methoxy-5-methylphenyl)-N-methyl-2-(methylamino)acetamide.

Molecular Properties

Compound NameN-(2-methoxy-5-methylphenyl)-N-methyl-2-(methylamino)acetamide
PubChem CID82494481
Molecular FormulaC12H18N2O2
Molecular Weight222.29 g/mol
Exact Mass222.14
IUPAC NameN-(2-methoxy-5-methylphenyl)-N-methyl-2-(methylamino)acetamide
SMILESCNCC(=O)N(C)c1cc(C)ccc1OC
InChIInChI=1S/C12H18N2O2/c1-9-5-6-11(16-4)10(7-9)14(3)12(15)8-13-2/h5-7,13H,8H2,1-4H3
InChIKeyWCGNKEKMXSQNTR-UHFFFAOYSA-N
XLogP1.19
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-chloro-N-(2-methoxy-5-methylphenyl)-N-methylpropanamide
CID 115162379
N-(2-methoxy-4,6-dimethylphenyl)-N-methyl-2-(methylamino)acetamide
CID 82496838
3-(2-methoxy-N,5-dimethylanilino)-2-(methylamino)-3-oxopropanoic acid
CID 115189358
2,2,2-trifluoro-N-(2-methoxy-5-methylphenyl)-N-methylacetamide
CID 115190160
1-cyano-N-(2-methoxy-5-methylphenyl)-N-methylformamide
CID 115171963
N-ethyl-2-methoxy-N,5-dimethylaniline
CID 58577971
3-amino-4-(2-methoxy-N,5-dimethylanilino)-4-oxobutanoic acid
CID 115181262
2-[N-(carboxymethyl)-2-methoxy-5-methylanilino]acetic acid
CID 94690899
1-amino-3-(2-methoxy-N,5-dimethylanilino)propan-2-one
CID 83822875
methyl 3-(2,5-dimethoxy-N-methylanilino)-3-oxopropanoate
CID 115174206
4-(2-methoxy-5-methylphenyl)-1-(methylamino)butan-2-one
CID 112517838
2-ethyl-N-(2-methoxy-5-methylphenyl)-N,N'-dimethylpropane-1,3-diamine
CID 115254869

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxy-5-methylphenyl)-N-methyl-2-(methylamino)acetamide?
The IUPAC name of N-(2-methoxy-5-methylphenyl)-N-methyl-2-(methylamino)acetamide (CID 82494481) is N-(2-methoxy-5-methylphenyl)-N-methyl-2-(methylamino)acetamide.
What is the SMILES notation for N-(2-methoxy-5-methylphenyl)-N-methyl-2-(methylamino)acetamide?
The canonical SMILES for N-(2-methoxy-5-methylphenyl)-N-methyl-2-(methylamino)acetamide is CNCC(=O)N(C)c1cc(C)ccc1OC.
What is the InChIKey of N-(2-methoxy-5-methylphenyl)-N-methyl-2-(methylamino)acetamide?
The InChIKey is WCGNKEKMXSQNTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2/c1-9-5-6-11(16-4)10(7-9)14(3)12(15)8-13-2/h5-7,13H,8H2,1-4H3.
What are the key properties of N-(2-methoxy-5-methylphenyl)-N-methyl-2-(methylamino)acetamide?
N-(2-methoxy-5-methylphenyl)-N-methyl-2-(methylamino)acetamide has a molecular weight of 222.29 g/mol, XLogP of 1.19, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxy-5-methylphenyl)-N-methyl-2-(methylamino)acetamide is sourced from PubChem (CID 82494481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).