3-[2-hydroxyethyl(methyl)amino]-N-(2-methoxyphenyl)propanamide

C13H20N2O3 — CID 62020448

IUPAC3-[2-hydroxyethyl(methyl)amino]-N-(2-methoxyphenyl)propanamide
SMILESCOc1ccccc1NC(=O)CCN(C)CCO
InChIInChI=1S/C13H20N2O3/c1-15(9-10-16)8-7-13(17)14-11-5-3-4-6-12(11)18-2/h3-6,16H,7-10H2,1-2H3,(H,14,17)
InChIKeyMTXXUAGJTOKOPT-UHFFFAOYSA-N
MW252.31 g/mol
LogP0.95
Rot. Bonds7

About 3-[2-hydroxyethyl(methyl)amino]-N-(2-methoxyphenyl)propanamide

3-[2-hydroxyethyl(methyl)amino]-N-(2-methoxyphenyl)propanamide (PubChem CID 62020448) has the molecular formula C13H20N2O3 and a molecular weight of 252.31 g/mol. Its IUPAC name is 3-[2-hydroxyethyl(methyl)amino]-N-(2-methoxyphenyl)propanamide.

Molecular Properties

Compound Name3-[2-hydroxyethyl(methyl)amino]-N-(2-methoxyphenyl)propanamide
PubChem CID62020448
Molecular FormulaC13H20N2O3
Molecular Weight252.31 g/mol
Exact Mass252.15
IUPAC Name3-[2-hydroxyethyl(methyl)amino]-N-(2-methoxyphenyl)propanamide
SMILESCOc1ccccc1NC(=O)CCN(C)CCO
InChIInChI=1S/C13H20N2O3/c1-15(9-10-16)8-7-13(17)14-11-5-3-4-6-12(11)18-2/h3-6,16H,7-10H2,1-2H3,(H,14,17)
InChIKeyMTXXUAGJTOKOPT-UHFFFAOYSA-N
XLogP0.95
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.31
LogP ≤ 50.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[bis(2-hydroxyethyl)amino]-N-(2-methoxyphenyl)acetamide
CID 18870897
4-[[[3-(2-methoxyanilino)-3-oxopropyl]-methylamino]methyl]-N-methylbenzamide
CID 37215281
3-[acetyl(propyl)amino]-N-(2-methoxyphenyl)propanamide
CID 113115042
N-(2-methoxyphenyl)-3-(methylamino)propanamide
CID 54773589
2-[butyl(methyl)amino]-N-(2-methoxyphenyl)acetamide
CID 109006138
3-(2,6-dimethoxyphenyl)-N-(2-methoxyphenyl)propanamide
CID 100789518
N,3-bis(2-methoxyphenyl)propanamide
CID 17394407
4,4,4-trifluoro-N-(2-methoxyphenyl)butanamide
CID 155941258
N-(2-methoxyphenyl)-3-[methyl(1-thiophen-2-ylethyl)amino]propanamide
CID 51303270
N-(2-methoxyphenyl)pent-4-ynamide
CID 82363143
3-(N-acetyl-3,5-dimethylanilino)-N-(2-methoxyphenyl)propanamide
CID 113124754
2-[[2-(2-methoxyanilino)-2-oxoethyl]disulfanyl]-N-(2-methoxyphenyl)acetamide
CID 2346844

Frequently Asked Questions

What is the IUPAC name of 3-[2-hydroxyethyl(methyl)amino]-N-(2-methoxyphenyl)propanamide?
The IUPAC name of 3-[2-hydroxyethyl(methyl)amino]-N-(2-methoxyphenyl)propanamide (CID 62020448) is 3-[2-hydroxyethyl(methyl)amino]-N-(2-methoxyphenyl)propanamide.
What is the SMILES notation for 3-[2-hydroxyethyl(methyl)amino]-N-(2-methoxyphenyl)propanamide?
The canonical SMILES for 3-[2-hydroxyethyl(methyl)amino]-N-(2-methoxyphenyl)propanamide is COc1ccccc1NC(=O)CCN(C)CCO.
What is the InChIKey of 3-[2-hydroxyethyl(methyl)amino]-N-(2-methoxyphenyl)propanamide?
The InChIKey is MTXXUAGJTOKOPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O3/c1-15(9-10-16)8-7-13(17)14-11-5-3-4-6-12(11)18-2/h3-6,16H,7-10H2,1-2H3,(H,14,17).
What are the key properties of 3-[2-hydroxyethyl(methyl)amino]-N-(2-methoxyphenyl)propanamide?
3-[2-hydroxyethyl(methyl)amino]-N-(2-methoxyphenyl)propanamide has a molecular weight of 252.31 g/mol, XLogP of 0.95, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-hydroxyethyl(methyl)amino]-N-(2-methoxyphenyl)propanamide is sourced from PubChem (CID 62020448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).