N-(3,5-dichloro-4-hydroxyphenyl)-4-hydroxybutanamide

C10H11Cl2NO3 — CID 107681679

IUPACN-(3,5-dichloro-4-hydroxyphenyl)-4-hydroxybutanamide
SMILESO=C(CCCO)Nc1cc(Cl)c(O)c(Cl)c1
InChIInChI=1S/C10H11Cl2NO3/c11-7-4-6(5-8(12)10(7)16)13-9(15)2-1-3-14/h4-5,14,16H,1-3H2,(H,13,15)
InChIKeyRATABQDLLZGBLA-UHFFFAOYSA-N
MW264.11 g/mol
LogP2.41
Rot. Bonds4

About N-(3,5-dichloro-4-hydroxyphenyl)-4-hydroxybutanamide

N-(3,5-dichloro-4-hydroxyphenyl)-4-hydroxybutanamide (PubChem CID 107681679) has the molecular formula C10H11Cl2NO3 and a molecular weight of 264.11 g/mol. Its IUPAC name is N-(3,5-dichloro-4-hydroxyphenyl)-4-hydroxybutanamide.

Molecular Properties

Compound NameN-(3,5-dichloro-4-hydroxyphenyl)-4-hydroxybutanamide
PubChem CID107681679
Molecular FormulaC10H11Cl2NO3
Molecular Weight264.11 g/mol
Exact Mass263.01
IUPAC NameN-(3,5-dichloro-4-hydroxyphenyl)-4-hydroxybutanamide
SMILESO=C(CCCO)Nc1cc(Cl)c(O)c(Cl)c1
InChIInChI=1S/C10H11Cl2NO3/c11-7-4-6(5-8(12)10(7)16)13-9(15)2-1-3-14/h4-5,14,16H,1-3H2,(H,13,15)
InChIKeyRATABQDLLZGBLA-UHFFFAOYSA-N
XLogP2.41
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.11
LogP ≤ 52.41
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-(3,5-dichloro-4-hydroxyphenyl)-4-hydroxybutanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(3,5-dichlorophenyl)-5-hydroxypentanamide
CID 79019042
4-(4-chlorophenyl)-N-(3,5-dichloro-4-hydroxyphenyl)-4-oxobutanamide
CID 108808181
4-bromo-N-(3,4,5-trichlorophenyl)butanamide
CID 71446010
N-(2,6-dichloro-4-fluorophenyl)-4-hydroxybutanamide
CID 83082072
N-(3,5-dichloro-4-hydroxyphenyl)-3-piperidin-4-ylpropanamide
CID 107680294
5-(4-amino-3,5-dichloroanilino)-5-oxopentanoic acid
CID 881207
N-(3,5-dichloro-4-hydroxyphenyl)-3-(3-methylphenyl)propanamide
CID 82881123
N-(3-chloro-4-ethoxyphenyl)-5-hydroxypentanamide
CID 79199515
N-(3,5-dichloro-4-hydroxyphenyl)-3-hydroxy-3-phenylbutanamide
CID 110026377
N-(3,5-dichloro-4-hydroxyphenyl)-2-(2,2,2-trifluoroethylamino)acetamide
CID 104786861
N-(4-chloro-3-methoxyphenyl)-5-hydroxypentanamide
CID 107623363
2-chloro-5-(5-hydroxypentanoylamino)-N-methylbenzamide
CID 79198792

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dichloro-4-hydroxyphenyl)-4-hydroxybutanamide?
The IUPAC name of N-(3,5-dichloro-4-hydroxyphenyl)-4-hydroxybutanamide (CID 107681679) is N-(3,5-dichloro-4-hydroxyphenyl)-4-hydroxybutanamide.
What is the SMILES notation for N-(3,5-dichloro-4-hydroxyphenyl)-4-hydroxybutanamide?
The canonical SMILES for N-(3,5-dichloro-4-hydroxyphenyl)-4-hydroxybutanamide is O=C(CCCO)Nc1cc(Cl)c(O)c(Cl)c1.
What is the InChIKey of N-(3,5-dichloro-4-hydroxyphenyl)-4-hydroxybutanamide?
The InChIKey is RATABQDLLZGBLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11Cl2NO3/c11-7-4-6(5-8(12)10(7)16)13-9(15)2-1-3-14/h4-5,14,16H,1-3H2,(H,13,15).
What are the key properties of N-(3,5-dichloro-4-hydroxyphenyl)-4-hydroxybutanamide?
N-(3,5-dichloro-4-hydroxyphenyl)-4-hydroxybutanamide has a molecular weight of 264.11 g/mol, XLogP of 2.41, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dichloro-4-hydroxyphenyl)-4-hydroxybutanamide is sourced from PubChem (CID 107681679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).