2-hydroxy-N-[2-(2-methoxyethylamino)ethyl]-5-methylbenzamide

C13H20N2O3 — CID 83039378

IUPAC2-hydroxy-N-[2-(2-methoxyethylamino)ethyl]-5-methylbenzamide
SMILESCOCCNCCNC(=O)c1cc(C)ccc1O
InChIInChI=1S/C13H20N2O3/c1-10-3-4-12(16)11(9-10)13(17)15-6-5-14-7-8-18-2/h3-4,9,14,16H,5-8H2,1-2H3,(H,15,17)
InChIKeyRMPTZASGTMOZOQ-UHFFFAOYSA-N
MW252.31 g/mol
LogP0.67
Rot. Bonds7

About 2-hydroxy-N-[2-(2-methoxyethylamino)ethyl]-5-methylbenzamide

2-hydroxy-N-[2-(2-methoxyethylamino)ethyl]-5-methylbenzamide (PubChem CID 83039378) has the molecular formula C13H20N2O3 and a molecular weight of 252.31 g/mol. Its IUPAC name is 2-hydroxy-N-[2-(2-methoxyethylamino)ethyl]-5-methylbenzamide.

Molecular Properties

Compound Name2-hydroxy-N-[2-(2-methoxyethylamino)ethyl]-5-methylbenzamide
PubChem CID83039378
Molecular FormulaC13H20N2O3
Molecular Weight252.31 g/mol
Exact Mass252.15
IUPAC Name2-hydroxy-N-[2-(2-methoxyethylamino)ethyl]-5-methylbenzamide
SMILESCOCCNCCNC(=O)c1cc(C)ccc1O
InChIInChI=1S/C13H20N2O3/c1-10-3-4-12(16)11(9-10)13(17)15-6-5-14-7-8-18-2/h3-4,9,14,16H,5-8H2,1-2H3,(H,15,17)
InChIKeyRMPTZASGTMOZOQ-UHFFFAOYSA-N
XLogP0.67
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.31
LogP ≤ 50.67
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-hydroxy-5-methyl-N-[2-(propylamino)ethyl]benzamide
CID 55100965
2-hydroxy-N-[2-(2-methoxyethylamino)ethyl]benzamide
CID 83039586
N-[2-(2-methoxyethylamino)ethyl]-5-methyl-2-nitrobenzamide
CID 82993906
2-hydroxy-4-methoxy-N-[2-(2-methoxyethylamino)ethyl]benzamide
CID 83039381
4-bromo-2-hydroxy-N-[2-(2-methoxyethylamino)ethyl]benzamide
CID 83038903
2-[2-[(2-hydroxy-5-methylbenzoyl)amino]ethoxy]acetic acid
CID 79456992
2-hydroxy-5-methyl-N-[3-(methylamino)propyl]benzamide
CID 43600759
N-[2-[2-(dimethylamino)ethoxy]ethyl]-2-hydroxy-5-methylbenzamide
CID 103939801
2-hydroxy-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]-5-methylbenzamide
CID 103801693
ethane;N-(2-methoxyethyl)-2,4-dimethylbenzamide
CID 178149105
5-chloro-2-methoxy-N-[2-(2-methoxyethylamino)ethyl]benzamide
CID 82994768
N-[2-(2-aminophenoxy)ethyl]-2-hydroxy-5-methylbenzamide
CID 61031629

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-[2-(2-methoxyethylamino)ethyl]-5-methylbenzamide?
The IUPAC name of 2-hydroxy-N-[2-(2-methoxyethylamino)ethyl]-5-methylbenzamide (CID 83039378) is 2-hydroxy-N-[2-(2-methoxyethylamino)ethyl]-5-methylbenzamide.
What is the SMILES notation for 2-hydroxy-N-[2-(2-methoxyethylamino)ethyl]-5-methylbenzamide?
The canonical SMILES for 2-hydroxy-N-[2-(2-methoxyethylamino)ethyl]-5-methylbenzamide is COCCNCCNC(=O)c1cc(C)ccc1O.
What is the InChIKey of 2-hydroxy-N-[2-(2-methoxyethylamino)ethyl]-5-methylbenzamide?
The InChIKey is RMPTZASGTMOZOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O3/c1-10-3-4-12(16)11(9-10)13(17)15-6-5-14-7-8-18-2/h3-4,9,14,16H,5-8H2,1-2H3,(H,15,17).
What are the key properties of 2-hydroxy-N-[2-(2-methoxyethylamino)ethyl]-5-methylbenzamide?
2-hydroxy-N-[2-(2-methoxyethylamino)ethyl]-5-methylbenzamide has a molecular weight of 252.31 g/mol, XLogP of 0.67, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-[2-(2-methoxyethylamino)ethyl]-5-methylbenzamide is sourced from PubChem (CID 83039378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).