2-(cyclohexylamino)-N-(2,5-dihydroxyphenyl)acetamide

C14H20N2O3 — CID 77460995

IUPAC2-(cyclohexylamino)-N-(2,5-dihydroxyphenyl)acetamide
SMILESO=C(CNC1CCCCC1)Nc1cc(O)ccc1O
InChIInChI=1S/C14H20N2O3/c17-11-6-7-13(18)12(8-11)16-14(19)9-15-10-4-2-1-3-5-10/h6-8,10,15,17-18H,1-5,9H2,(H,16,19)
InChIKeyIFGKCXKKPDHRHH-UHFFFAOYSA-N
MW264.32 g/mol
LogP1.96
Rot. Bonds4

About 2-(cyclohexylamino)-N-(2,5-dihydroxyphenyl)acetamide

2-(cyclohexylamino)-N-(2,5-dihydroxyphenyl)acetamide (PubChem CID 77460995) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is 2-(cyclohexylamino)-N-(2,5-dihydroxyphenyl)acetamide.

Molecular Properties

Compound Name2-(cyclohexylamino)-N-(2,5-dihydroxyphenyl)acetamide
PubChem CID77460995
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC Name2-(cyclohexylamino)-N-(2,5-dihydroxyphenyl)acetamide
SMILESO=C(CNC1CCCCC1)Nc1cc(O)ccc1O
InChIInChI=1S/C14H20N2O3/c17-11-6-7-13(18)12(8-11)16-14(19)9-15-10-4-2-1-3-5-10/h6-8,10,15,17-18H,1-5,9H2,(H,16,19)
InChIKeyIFGKCXKKPDHRHH-UHFFFAOYSA-N
XLogP1.96
TPSA81.59 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 51.96
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(cyclohexylamino)-N-(2,5-dihydroxyphenyl)acetamide?
The IUPAC name of 2-(cyclohexylamino)-N-(2,5-dihydroxyphenyl)acetamide (CID 77460995) is 2-(cyclohexylamino)-N-(2,5-dihydroxyphenyl)acetamide.
What is the SMILES notation for 2-(cyclohexylamino)-N-(2,5-dihydroxyphenyl)acetamide?
The canonical SMILES for 2-(cyclohexylamino)-N-(2,5-dihydroxyphenyl)acetamide is O=C(CNC1CCCCC1)Nc1cc(O)ccc1O.
What is the InChIKey of 2-(cyclohexylamino)-N-(2,5-dihydroxyphenyl)acetamide?
The InChIKey is IFGKCXKKPDHRHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3/c17-11-6-7-13(18)12(8-11)16-14(19)9-15-10-4-2-1-3-5-10/h6-8,10,15,17-18H,1-5,9H2,(H,16,19).
What are the key properties of 2-(cyclohexylamino)-N-(2,5-dihydroxyphenyl)acetamide?
2-(cyclohexylamino)-N-(2,5-dihydroxyphenyl)acetamide has a molecular weight of 264.32 g/mol, XLogP of 1.96, 4 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclohexylamino)-N-(2,5-dihydroxyphenyl)acetamide is sourced from PubChem (CID 77460995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).