N-(2,3-diethyl-5-hydroxyphenyl)acetamide

C12H17NO2 — CID 177164029

IUPACN-(2,3-diethyl-5-hydroxyphenyl)acetamide
SMILESCCc1cc(O)cc(NC(C)=O)c1CC
InChIInChI=1S/C12H17NO2/c1-4-9-6-10(15)7-12(11(9)5-2)13-8(3)14/h6-7,15H,4-5H2,1-3H3,(H,13,14)
InChIKeyFBWSJXVVEIQADY-UHFFFAOYSA-N
MW207.27 g/mol
LogP2.48
Rot. Bonds3

About N-(2,3-diethyl-5-hydroxyphenyl)acetamide

N-(2,3-diethyl-5-hydroxyphenyl)acetamide (PubChem CID 177164029) has the molecular formula C12H17NO2 and a molecular weight of 207.27 g/mol. Its IUPAC name is N-(2,3-diethyl-5-hydroxyphenyl)acetamide.

Molecular Properties

Compound NameN-(2,3-diethyl-5-hydroxyphenyl)acetamide
PubChem CID177164029
Molecular FormulaC12H17NO2
Molecular Weight207.27 g/mol
Exact Mass207.13
IUPAC NameN-(2,3-diethyl-5-hydroxyphenyl)acetamide
SMILESCCc1cc(O)cc(NC(C)=O)c1CC
InChIInChI=1S/C12H17NO2/c1-4-9-6-10(15)7-12(11(9)5-2)13-8(3)14/h6-7,15H,4-5H2,1-3H3,(H,13,14)
InChIKeyFBWSJXVVEIQADY-UHFFFAOYSA-N
XLogP2.48
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.27
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2,3-diethyl-5-hydroxyphenyl)acetamide?
The IUPAC name of N-(2,3-diethyl-5-hydroxyphenyl)acetamide (CID 177164029) is N-(2,3-diethyl-5-hydroxyphenyl)acetamide.
What is the SMILES notation for N-(2,3-diethyl-5-hydroxyphenyl)acetamide?
The canonical SMILES for N-(2,3-diethyl-5-hydroxyphenyl)acetamide is CCc1cc(O)cc(NC(C)=O)c1CC.
What is the InChIKey of N-(2,3-diethyl-5-hydroxyphenyl)acetamide?
The InChIKey is FBWSJXVVEIQADY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO2/c1-4-9-6-10(15)7-12(11(9)5-2)13-8(3)14/h6-7,15H,4-5H2,1-3H3,(H,13,14).
What are the key properties of N-(2,3-diethyl-5-hydroxyphenyl)acetamide?
N-(2,3-diethyl-5-hydroxyphenyl)acetamide has a molecular weight of 207.27 g/mol, XLogP of 2.48, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-diethyl-5-hydroxyphenyl)acetamide is sourced from PubChem (CID 177164029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).