2-hydroxy-N-[(2-methoxy-5-propan-2-ylphenyl)methyl]acetamide

C13H19NO3 — CID 94687136

IUPAC2-hydroxy-N-[(2-methoxy-5-propan-2-ylphenyl)methyl]acetamide
SMILESCOc1ccc(C(C)C)cc1CNC(=O)CO
InChIInChI=1S/C13H19NO3/c1-9(2)10-4-5-12(17-3)11(6-10)7-14-13(16)8-15/h4-6,9,15H,7-8H2,1-3H3,(H,14,16)
InChIKeyBZOUCPMEVGQURP-UHFFFAOYSA-N
MW237.30 g/mol
LogP1.43
Rot. Bonds5

About 2-hydroxy-N-[(2-methoxy-5-propan-2-ylphenyl)methyl]acetamide

2-hydroxy-N-[(2-methoxy-5-propan-2-ylphenyl)methyl]acetamide (PubChem CID 94687136) has the molecular formula C13H19NO3 and a molecular weight of 237.30 g/mol. Its IUPAC name is 2-hydroxy-N-[(2-methoxy-5-propan-2-ylphenyl)methyl]acetamide.

Molecular Properties

Compound Name2-hydroxy-N-[(2-methoxy-5-propan-2-ylphenyl)methyl]acetamide
PubChem CID94687136
Molecular FormulaC13H19NO3
Molecular Weight237.30 g/mol
Exact Mass237.14
IUPAC Name2-hydroxy-N-[(2-methoxy-5-propan-2-ylphenyl)methyl]acetamide
SMILESCOc1ccc(C(C)C)cc1CNC(=O)CO
InChIInChI=1S/C13H19NO3/c1-9(2)10-4-5-12(17-3)11(6-10)7-14-13(16)8-15/h4-6,9,15H,7-8H2,1-3H3,(H,14,16)
InChIKeyBZOUCPMEVGQURP-UHFFFAOYSA-N
XLogP1.43
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 51.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2-methoxy-5-propan-2-ylphenyl)methyl]-2-sulfanylacetamide
CID 115167149
N-[(2-methoxy-5-propan-2-ylphenyl)methyl]acetamide
CID 110780628
N-[(2-methoxy-5-propan-2-ylphenyl)methyl]-3-sulfanylpropanamide
CID 115167836
N-[(2-methoxy-5-propan-2-ylphenyl)methyl]-3-(methylamino)propanamide
CID 115153227
2-hydroxy-N-(2-methoxy-5-propan-2-ylphenyl)acetamide
CID 115139566
4-[(2-methoxy-5-propan-2-ylphenyl)methylamino]butan-2-one
CID 115235635
N-cyclopentyl-2-(2-methoxy-5-propan-2-ylphenyl)acetamide
CID 110767613
2-(2-methoxy-5-propan-2-ylphenyl)-N-(pyridin-3-ylmethyl)acetamide
CID 110767628
2-amino-3-[(2-methoxy-5-propan-2-ylphenyl)methylamino]propanoic acid
CID 115240663
4-[(2-methoxy-5-propan-2-ylphenyl)methylamino]butanoic acid
CID 115218601
N-[(2-methoxy-5-propan-2-ylphenyl)methyl]-1,3-benzodioxole-5-carboxamide
CID 110793620
[(2-methoxy-5-propan-2-ylphenyl)methylamino]methanethiol
CID 115227896

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-[(2-methoxy-5-propan-2-ylphenyl)methyl]acetamide?
The IUPAC name of 2-hydroxy-N-[(2-methoxy-5-propan-2-ylphenyl)methyl]acetamide (CID 94687136) is 2-hydroxy-N-[(2-methoxy-5-propan-2-ylphenyl)methyl]acetamide.
What is the SMILES notation for 2-hydroxy-N-[(2-methoxy-5-propan-2-ylphenyl)methyl]acetamide?
The canonical SMILES for 2-hydroxy-N-[(2-methoxy-5-propan-2-ylphenyl)methyl]acetamide is COc1ccc(C(C)C)cc1CNC(=O)CO.
What is the InChIKey of 2-hydroxy-N-[(2-methoxy-5-propan-2-ylphenyl)methyl]acetamide?
The InChIKey is BZOUCPMEVGQURP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO3/c1-9(2)10-4-5-12(17-3)11(6-10)7-14-13(16)8-15/h4-6,9,15H,7-8H2,1-3H3,(H,14,16).
What are the key properties of 2-hydroxy-N-[(2-methoxy-5-propan-2-ylphenyl)methyl]acetamide?
2-hydroxy-N-[(2-methoxy-5-propan-2-ylphenyl)methyl]acetamide has a molecular weight of 237.30 g/mol, XLogP of 1.43, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-[(2-methoxy-5-propan-2-ylphenyl)methyl]acetamide is sourced from PubChem (CID 94687136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).