2-(2,6-dimethoxyphenyl)-2-hydroxypropanediamide

C11H14N2O5 — CID 70450290

IUPAC2-(2,6-dimethoxyphenyl)-2-hydroxypropanediamide
SMILESCOc1cccc(OC)c1C(O)(C(N)=O)C(N)=O
InChIInChI=1S/C11H14N2O5/c1-17-6-4-3-5-7(18-2)8(6)11(16,9(12)14)10(13)15/h3-5,16H,1-2H3,(H2,12,14)(H2,13,15)
InChIKeyMCFIUMFSHFOETG-UHFFFAOYSA-N
MW254.24 g/mol
LogP-1.14
Rot. Bonds5

About 2-(2,6-dimethoxyphenyl)-2-hydroxypropanediamide

2-(2,6-dimethoxyphenyl)-2-hydroxypropanediamide (PubChem CID 70450290) has the molecular formula C11H14N2O5 and a molecular weight of 254.24 g/mol. Its IUPAC name is 2-(2,6-dimethoxyphenyl)-2-hydroxypropanediamide.

Molecular Properties

Compound Name2-(2,6-dimethoxyphenyl)-2-hydroxypropanediamide
PubChem CID70450290
Molecular FormulaC11H14N2O5
Molecular Weight254.24 g/mol
Exact Mass254.09
IUPAC Name2-(2,6-dimethoxyphenyl)-2-hydroxypropanediamide
SMILESCOc1cccc(OC)c1C(O)(C(N)=O)C(N)=O
InChIInChI=1S/C11H14N2O5/c1-17-6-4-3-5-7(18-2)8(6)11(16,9(12)14)10(13)15/h3-5,16H,1-2H3,(H2,12,14)(H2,13,15)
InChIKeyMCFIUMFSHFOETG-UHFFFAOYSA-N
XLogP-1.14
TPSA124.87 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.24
LogP ≤ 5-1.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}

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Related Compounds

2-(2-methoxy-6-nitrophenyl)-2-methylpropanamide
CID 606095
2,2-bis(2-methoxyphenyl)propanediamide
CID 118221758
3-methoxy-2-(2-methylbutan-2-yl)benzamide
CID 146620823
1,3-dimethoxy-2-(trichloromethyl)benzene
CID 174688195
2-tert-butyl-3-methoxybenzoyl chloride
CID 143795822
1-amino-2-(2,6-dimethoxyphenyl)-3-methylbutan-2-ol
CID 116809832
1-(2,6-dimethoxyphenyl)-1-(2-methoxyphenyl)ethanol
CID 116809641
(2-hydroxy-3-methoxyphenyl) carbamate
CID 68617707
2-amino-1-(2,6-dimethoxyphenyl)-1-phenylethanol
CID 116809834
2-(butan-2-ylamino)-2-(2-fluoro-6-methoxyphenyl)propanamide
CID 113388819
4-(2,6-dimethoxyphenyl)-4-oxobutanamide
CID 70615258
2,3-dimethoxybenzamide;hydrate
CID 141005510

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dimethoxyphenyl)-2-hydroxypropanediamide?
The IUPAC name of 2-(2,6-dimethoxyphenyl)-2-hydroxypropanediamide (CID 70450290) is 2-(2,6-dimethoxyphenyl)-2-hydroxypropanediamide.
What is the SMILES notation for 2-(2,6-dimethoxyphenyl)-2-hydroxypropanediamide?
The canonical SMILES for 2-(2,6-dimethoxyphenyl)-2-hydroxypropanediamide is COc1cccc(OC)c1C(O)(C(N)=O)C(N)=O.
What is the InChIKey of 2-(2,6-dimethoxyphenyl)-2-hydroxypropanediamide?
The InChIKey is MCFIUMFSHFOETG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O5/c1-17-6-4-3-5-7(18-2)8(6)11(16,9(12)14)10(13)15/h3-5,16H,1-2H3,(H2,12,14)(H2,13,15).
What are the key properties of 2-(2,6-dimethoxyphenyl)-2-hydroxypropanediamide?
2-(2,6-dimethoxyphenyl)-2-hydroxypropanediamide has a molecular weight of 254.24 g/mol, XLogP of -1.14, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dimethoxyphenyl)-2-hydroxypropanediamide is sourced from PubChem (CID 70450290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).