N-(2-hydroxycyclohexyl)-2-(4-hydroxyphenyl)acetamide

C14H19NO3 — CID 62361084

IUPACN-(2-hydroxycyclohexyl)-2-(4-hydroxyphenyl)acetamide
SMILESO=C(Cc1ccc(O)cc1)NC1CCCCC1O
InChIInChI=1S/C14H19NO3/c16-11-7-5-10(6-8-11)9-14(18)15-12-3-1-2-4-13(12)17/h5-8,12-13,16-17H,1-4,9H2,(H,15,18)
InChIKeyOHCBZLFAMBAZCS-UHFFFAOYSA-N
MW249.31 g/mol
LogP1.35
Rot. Bonds3

About N-(2-hydroxycyclohexyl)-2-(4-hydroxyphenyl)acetamide

N-(2-hydroxycyclohexyl)-2-(4-hydroxyphenyl)acetamide (PubChem CID 62361084) has the molecular formula C14H19NO3 and a molecular weight of 249.31 g/mol. Its IUPAC name is N-(2-hydroxycyclohexyl)-2-(4-hydroxyphenyl)acetamide.

Molecular Properties

Compound NameN-(2-hydroxycyclohexyl)-2-(4-hydroxyphenyl)acetamide
PubChem CID62361084
Molecular FormulaC14H19NO3
Molecular Weight249.31 g/mol
Exact Mass249.14
IUPAC NameN-(2-hydroxycyclohexyl)-2-(4-hydroxyphenyl)acetamide
SMILESO=C(Cc1ccc(O)cc1)NC1CCCCC1O
InChIInChI=1S/C14H19NO3/c16-11-7-5-10(6-8-11)9-14(18)15-12-3-1-2-4-13(12)17/h5-8,12-13,16-17H,1-4,9H2,(H,15,18)
InChIKeyOHCBZLFAMBAZCS-UHFFFAOYSA-N
XLogP1.35
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.31
LogP ≤ 51.35
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxycyclohexyl)-2-(4-hydroxyphenyl)acetamide?
The IUPAC name of N-(2-hydroxycyclohexyl)-2-(4-hydroxyphenyl)acetamide (CID 62361084) is N-(2-hydroxycyclohexyl)-2-(4-hydroxyphenyl)acetamide.
What is the SMILES notation for N-(2-hydroxycyclohexyl)-2-(4-hydroxyphenyl)acetamide?
The canonical SMILES for N-(2-hydroxycyclohexyl)-2-(4-hydroxyphenyl)acetamide is O=C(Cc1ccc(O)cc1)NC1CCCCC1O.
What is the InChIKey of N-(2-hydroxycyclohexyl)-2-(4-hydroxyphenyl)acetamide?
The InChIKey is OHCBZLFAMBAZCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO3/c16-11-7-5-10(6-8-11)9-14(18)15-12-3-1-2-4-13(12)17/h5-8,12-13,16-17H,1-4,9H2,(H,15,18).
What are the key properties of N-(2-hydroxycyclohexyl)-2-(4-hydroxyphenyl)acetamide?
N-(2-hydroxycyclohexyl)-2-(4-hydroxyphenyl)acetamide has a molecular weight of 249.31 g/mol, XLogP of 1.35, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxycyclohexyl)-2-(4-hydroxyphenyl)acetamide is sourced from PubChem (CID 62361084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).