2-hydroxy-N-(2-methoxy-5-propan-2-ylphenyl)acetamide

C12H17NO3 — CID 115139566

IUPAC2-hydroxy-N-(2-methoxy-5-propan-2-ylphenyl)acetamide
SMILESCOc1ccc(C(C)C)cc1NC(=O)CO
InChIInChI=1S/C12H17NO3/c1-8(2)9-4-5-11(16-3)10(6-9)13-12(15)7-14/h4-6,8,14H,7H2,1-3H3,(H,13,15)
InChIKeyZHBJYMCPOVMAIW-UHFFFAOYSA-N
MW223.27 g/mol
LogP1.75
Rot. Bonds4

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

2-hydroxy-N-(2-methoxy-5-propan-2-ylphenyl)acetamide (PubChem CID 115139566) has the molecular formula C12H17NO3 and a molecular weight of 223.27 g/mol. Its IUPAC name is 2-hydroxy-N-(2-methoxy-5-propan-2-ylphenyl)acetamide.

Molecular Properties

Compound Name2-hydroxy-N-(2-methoxy-5-propan-2-ylphenyl)acetamide
PubChem CID115139566
Molecular FormulaC12H17NO3
Molecular Weight223.27 g/mol
Exact Mass223.12
IUPAC Name2-hydroxy-N-(2-methoxy-5-propan-2-ylphenyl)acetamide
SMILESCOc1ccc(C(C)C)cc1NC(=O)CO
InChIInChI=1S/C12H17NO3/c1-8(2)9-4-5-11(16-3)10(6-9)13-12(15)7-14/h4-6,8,14H,7H2,1-3H3,(H,13,15)
InChIKeyZHBJYMCPOVMAIW-UHFFFAOYSA-N
XLogP1.75
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.27
LogP ≤ 51.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-(2-methoxy-5-propan-2-ylphenyl)acetamide?
The IUPAC name of 2-hydroxy-N-(2-methoxy-5-propan-2-ylphenyl)acetamide (CID 115139566) is 2-hydroxy-N-(2-methoxy-5-propan-2-ylphenyl)acetamide.
What is the SMILES notation for 2-hydroxy-N-(2-methoxy-5-propan-2-ylphenyl)acetamide?
The canonical SMILES for 2-hydroxy-N-(2-methoxy-5-propan-2-ylphenyl)acetamide is COc1ccc(C(C)C)cc1NC(=O)CO.
What is the InChIKey of 2-hydroxy-N-(2-methoxy-5-propan-2-ylphenyl)acetamide?
The InChIKey is ZHBJYMCPOVMAIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO3/c1-8(2)9-4-5-11(16-3)10(6-9)13-12(15)7-14/h4-6,8,14H,7H2,1-3H3,(H,13,15).
What are the key properties of 2-hydroxy-N-(2-methoxy-5-propan-2-ylphenyl)acetamide?
2-hydroxy-N-(2-methoxy-5-propan-2-ylphenyl)acetamide has a molecular weight of 223.27 g/mol, XLogP of 1.75, 4 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)acetamide is sourced from PubChem (CID 115139566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).