2-amino-2-(2,5-dimethoxy-3,4-dimethylphenyl)-N-methylacetamide

C13H20N2O3 — CID 116850472

IUPAC2-amino-2-(2,5-dimethoxy-3,4-dimethylphenyl)-N-methylacetamide
SMILESCNC(=O)C(N)c1cc(OC)c(C)c(C)c1OC
InChIInChI=1S/C13H20N2O3/c1-7-8(2)12(18-5)9(6-10(7)17-4)11(14)13(16)15-3/h6,11H,14H2,1-5H3,(H,15,16)
InChIKeyDJEVXTLCZPMKAS-UHFFFAOYSA-N
MW252.31 g/mol
LogP1.07
Rot. Bonds4

About 2-amino-2-(2,5-dimethoxy-3,4-dimethylphenyl)-N-methylacetamide

2-amino-2-(2,5-dimethoxy-3,4-dimethylphenyl)-N-methylacetamide (PubChem CID 116850472) has the molecular formula C13H20N2O3 and a molecular weight of 252.31 g/mol. Its IUPAC name is 2-amino-2-(2,5-dimethoxy-3,4-dimethylphenyl)-N-methylacetamide.

Molecular Properties

Compound Name2-amino-2-(2,5-dimethoxy-3,4-dimethylphenyl)-N-methylacetamide
PubChem CID116850472
Molecular FormulaC13H20N2O3
Molecular Weight252.31 g/mol
Exact Mass252.15
IUPAC Name2-amino-2-(2,5-dimethoxy-3,4-dimethylphenyl)-N-methylacetamide
SMILESCNC(=O)C(N)c1cc(OC)c(C)c(C)c1OC
InChIInChI=1S/C13H20N2O3/c1-7-8(2)12(18-5)9(6-10(7)17-4)11(14)13(16)15-3/h6,11H,14H2,1-5H3,(H,15,16)
InChIKeyDJEVXTLCZPMKAS-UHFFFAOYSA-N
XLogP1.07
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.31
LogP ≤ 51.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-2-(2,5-dimethoxy-3,4-dimethylphenyl)acetohydrazide
CID 116848546
methyl 2-(2,5-dimethoxy-3,4-dimethylphenyl)butanoate
CID 116964458
(2,5-dimethoxy-3,4-dimethylphenyl)-(methylamino)methanol
CID 116954760
2-amino-2-(5-tert-butyl-2-methoxyphenyl)-N-methylacetamide
CID 116850378
2-amino-2-(2-methoxy-4,5-dimethylphenyl)-N'-methylacetohydrazide
CID 116849362
methyl 2-amino-2-(4-methoxy-2,3,6-trimethylphenyl)acetate
CID 116856970
2-amino-3-(2,5-dimethoxy-3,4-dimethylphenyl)propanehydrazide
CID 116848706
1-(2,5-dimethoxy-3,4-dimethylphenyl)-N'-ethylethane-1,2-diamine
CID 116934991
3-(2,5-dimethoxy-3,4-dimethylphenyl)-3-(methylamino)propan-1-ol
CID 116952894
1-[(2,5-dimethoxy-3,4-dimethylphenyl)methyl]-3-methylurea
CID 115169191
2-amino-2-(3-chloro-4,5-dimethoxy-2-methylphenyl)acetic acid
CID 117403292
2-amino-2-(3-bromo-4,5-dimethoxy-2-methylphenyl)acetic acid
CID 117488962

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-(2,5-dimethoxy-3,4-dimethylphenyl)-N-methylacetamide?
The IUPAC name of 2-amino-2-(2,5-dimethoxy-3,4-dimethylphenyl)-N-methylacetamide (CID 116850472) is 2-amino-2-(2,5-dimethoxy-3,4-dimethylphenyl)-N-methylacetamide.
What is the SMILES notation for 2-amino-2-(2,5-dimethoxy-3,4-dimethylphenyl)-N-methylacetamide?
The canonical SMILES for 2-amino-2-(2,5-dimethoxy-3,4-dimethylphenyl)-N-methylacetamide is CNC(=O)C(N)c1cc(OC)c(C)c(C)c1OC.
What is the InChIKey of 2-amino-2-(2,5-dimethoxy-3,4-dimethylphenyl)-N-methylacetamide?
The InChIKey is DJEVXTLCZPMKAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O3/c1-7-8(2)12(18-5)9(6-10(7)17-4)11(14)13(16)15-3/h6,11H,14H2,1-5H3,(H,15,16).
What are the key properties of 2-amino-2-(2,5-dimethoxy-3,4-dimethylphenyl)-N-methylacetamide?
2-amino-2-(2,5-dimethoxy-3,4-dimethylphenyl)-N-methylacetamide has a molecular weight of 252.31 g/mol, XLogP of 1.07, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-(2,5-dimethoxy-3,4-dimethylphenyl)-N-methylacetamide is sourced from PubChem (CID 116850472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).