N-(2,5-dihydroxyphenyl)acetamide

C8H9NO3 — CID 6433002

IUPACN-(2,5-dihydroxyphenyl)acetamide
SMILESCC(=O)Nc1cc(O)ccc1O
InChIInChI=1S/C8H9NO3/c1-5(10)9-7-4-6(11)2-3-8(7)12/h2-4,11-12H,1H3,(H,9,10)
InChIKeyIKDULNHJECGNTK-UHFFFAOYSA-N
MW167.16 g/mol
LogP1.06
Rot. Bonds1

About N-(2,5-dihydroxyphenyl)acetamide

N-(2,5-dihydroxyphenyl)acetamide (PubChem CID 6433002) has the molecular formula C8H9NO3 and a molecular weight of 167.16 g/mol. Its IUPAC name is N-(2,5-dihydroxyphenyl)acetamide.

Molecular Properties

Compound NameN-(2,5-dihydroxyphenyl)acetamide
PubChem CID6433002
Molecular FormulaC8H9NO3
Molecular Weight167.16 g/mol
Exact Mass167.06
IUPAC NameN-(2,5-dihydroxyphenyl)acetamide
SMILESCC(=O)Nc1cc(O)ccc1O
InChIInChI=1S/C8H9NO3/c1-5(10)9-7-4-6(11)2-3-8(7)12/h2-4,11-12H,1H3,(H,9,10)
InChIKeyIKDULNHJECGNTK-UHFFFAOYSA-N
XLogP1.06
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.16
LogP ≤ 51.06
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-Hydroxyacetanilide
CID 12124
Acetarsol
CID 1985
2-Acetamidophenol
CID 11972
Carbamic acid, N-(3-hydroxyphenyl)-, ethyl ester
CID 23548
Methyl (3-hydroxyphenyl)-carbamate
CID 26181
Dephostatin
CID 2990
3-Ethylaminophenol
CID 578991
N-(2,5-Dimethoxyphenyl)acetamide
CID 77015
N-(3,5-dihydroxyphenyl)acetamide
CID 792929
3-Hydroxyacetaminophen
CID 161950
m-Hydroxyphenylurea
CID 12796
Butanamide, N-(3-hydroxyphenyl)-3-oxo-
CID 89150

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dihydroxyphenyl)acetamide?
The IUPAC name of N-(2,5-dihydroxyphenyl)acetamide (CID 6433002) is N-(2,5-dihydroxyphenyl)acetamide.
What is the SMILES notation for N-(2,5-dihydroxyphenyl)acetamide?
The canonical SMILES for N-(2,5-dihydroxyphenyl)acetamide is CC(=O)Nc1cc(O)ccc1O.
What is the InChIKey of N-(2,5-dihydroxyphenyl)acetamide?
The InChIKey is IKDULNHJECGNTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9NO3/c1-5(10)9-7-4-6(11)2-3-8(7)12/h2-4,11-12H,1H3,(H,9,10).
What are the key properties of N-(2,5-dihydroxyphenyl)acetamide?
N-(2,5-dihydroxyphenyl)acetamide has a molecular weight of 167.16 g/mol, XLogP of 1.06, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dihydroxyphenyl)acetamide is sourced from PubChem (CID 6433002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).