N-[2-(cyclohexanecarbonyl)-4-hydroxyphenyl]acetamide

C15H19NO3 — CID 67874762

IUPACN-[2-(cyclohexanecarbonyl)-4-hydroxyphenyl]acetamide
SMILESCC(=O)Nc1ccc(O)cc1C(=O)C1CCCCC1
InChIInChI=1S/C15H19NO3/c1-10(17)16-14-8-7-12(18)9-13(14)15(19)11-5-3-2-4-6-11/h7-9,11,18H,2-6H2,1H3,(H,16,17)
InChIKeyYSRXFPKNFVKIRF-UHFFFAOYSA-N
MW261.32 g/mol
LogP3.11
Rot. Bonds3

About N-[2-(cyclohexanecarbonyl)-4-hydroxyphenyl]acetamide

N-[2-(cyclohexanecarbonyl)-4-hydroxyphenyl]acetamide (PubChem CID 67874762) has the molecular formula C15H19NO3 and a molecular weight of 261.32 g/mol. Its IUPAC name is N-[2-(cyclohexanecarbonyl)-4-hydroxyphenyl]acetamide.

Molecular Properties

Compound NameN-[2-(cyclohexanecarbonyl)-4-hydroxyphenyl]acetamide
PubChem CID67874762
Molecular FormulaC15H19NO3
Molecular Weight261.32 g/mol
Exact Mass261.14
IUPAC NameN-[2-(cyclohexanecarbonyl)-4-hydroxyphenyl]acetamide
SMILESCC(=O)Nc1ccc(O)cc1C(=O)C1CCCCC1
InChIInChI=1S/C15H19NO3/c1-10(17)16-14-8-7-12(18)9-13(14)15(19)11-5-3-2-4-6-11/h7-9,11,18H,2-6H2,1H3,(H,16,17)
InChIKeyYSRXFPKNFVKIRF-UHFFFAOYSA-N
XLogP3.11
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 53.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[2-(cyclohexanecarbonyl)-4-hydroxyphenyl]acetamide?
The IUPAC name of N-[2-(cyclohexanecarbonyl)-4-hydroxyphenyl]acetamide (CID 67874762) is N-[2-(cyclohexanecarbonyl)-4-hydroxyphenyl]acetamide.
What is the SMILES notation for N-[2-(cyclohexanecarbonyl)-4-hydroxyphenyl]acetamide?
The canonical SMILES for N-[2-(cyclohexanecarbonyl)-4-hydroxyphenyl]acetamide is CC(=O)Nc1ccc(O)cc1C(=O)C1CCCCC1.
What is the InChIKey of N-[2-(cyclohexanecarbonyl)-4-hydroxyphenyl]acetamide?
The InChIKey is YSRXFPKNFVKIRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO3/c1-10(17)16-14-8-7-12(18)9-13(14)15(19)11-5-3-2-4-6-11/h7-9,11,18H,2-6H2,1H3,(H,16,17).
What are the key properties of N-[2-(cyclohexanecarbonyl)-4-hydroxyphenyl]acetamide?
N-[2-(cyclohexanecarbonyl)-4-hydroxyphenyl]acetamide has a molecular weight of 261.32 g/mol, XLogP of 3.11, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(cyclohexanecarbonyl)-4-hydroxyphenyl]acetamide is sourced from PubChem (CID 67874762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).