N-(3-chloro-4-hydroxyphenyl)-2-pyridin-4-ylacetamide

C13H11ClN2O2 — CID 64787327

IUPACN-(3-chloro-4-hydroxyphenyl)-2-pyridin-4-ylacetamide
SMILESO=C(Cc1ccncc1)Nc1ccc(O)c(Cl)c1
InChIInChI=1S/C13H11ClN2O2/c14-11-8-10(1-2-12(11)17)16-13(18)7-9-3-5-15-6-4-9/h1-6,8,17H,7H2,(H,16,18)
InChIKeyBHVGHRFBYJFBBD-UHFFFAOYSA-N
MW262.70 g/mol
LogP2.62
Rot. Bonds3

About N-(3-chloro-4-hydroxyphenyl)-2-pyridin-4-ylacetamide

N-(3-chloro-4-hydroxyphenyl)-2-pyridin-4-ylacetamide (PubChem CID 64787327) has the molecular formula C13H11ClN2O2 and a molecular weight of 262.70 g/mol. Its IUPAC name is N-(3-chloro-4-hydroxyphenyl)-2-pyridin-4-ylacetamide.

Molecular Properties

Compound NameN-(3-chloro-4-hydroxyphenyl)-2-pyridin-4-ylacetamide
PubChem CID64787327
Molecular FormulaC13H11ClN2O2
Molecular Weight262.70 g/mol
Exact Mass262.05
IUPAC NameN-(3-chloro-4-hydroxyphenyl)-2-pyridin-4-ylacetamide
SMILESO=C(Cc1ccncc1)Nc1ccc(O)c(Cl)c1
InChIInChI=1S/C13H11ClN2O2/c14-11-8-10(1-2-12(11)17)16-13(18)7-9-3-5-15-6-4-9/h1-6,8,17H,7H2,(H,16,18)
InChIKeyBHVGHRFBYJFBBD-UHFFFAOYSA-N
XLogP2.62
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.70
LogP ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N,2-dipyridin-4-ylacetamide
CID 110468100
N-(3,4-dimethylphenyl)-2-pyridin-4-ylacetamide
CID 110697303
N-(4-fluorophenyl)-2-pyridin-4-ylacetamide
CID 110697317
N-(3,4-dichlorophenyl)-2-(4-sulfanylphenyl)acetamide
CID 107020559
N-(4-chloro-3-hydroxyphenyl)-2-(4-hydroxyphenyl)acetamide
CID 64788064
1-(3-chloro-4-hydroxyphenyl)-3-(3,4-dichlorophenyl)urea
CID 64788304
N-(3-chloro-4-hydroxyphenyl)-3-phenylpropanamide
CID 63936302
N-(3-chloro-4-hydroxyphenyl)-2-(1,2,4-triazol-1-yl)acetamide
CID 64788698
N-(4-chloro-3-hydroxyphenyl)-2-(4-methylphenyl)acetamide
CID 64787693
N-(3-chloro-4-hydroxyphenyl)-3-(4-chlorophenyl)-3-hydroxypropanamide
CID 110026063
N-(4-methoxyphenyl)-2-pyridin-4-ylacetamide
CID 110697333
N-(3-chloro-4-fluorophenyl)-2-phenylacetamide
CID 871803

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-4-hydroxyphenyl)-2-pyridin-4-ylacetamide?
The IUPAC name of N-(3-chloro-4-hydroxyphenyl)-2-pyridin-4-ylacetamide (CID 64787327) is N-(3-chloro-4-hydroxyphenyl)-2-pyridin-4-ylacetamide.
What is the SMILES notation for N-(3-chloro-4-hydroxyphenyl)-2-pyridin-4-ylacetamide?
The canonical SMILES for N-(3-chloro-4-hydroxyphenyl)-2-pyridin-4-ylacetamide is O=C(Cc1ccncc1)Nc1ccc(O)c(Cl)c1.
What is the InChIKey of N-(3-chloro-4-hydroxyphenyl)-2-pyridin-4-ylacetamide?
The InChIKey is BHVGHRFBYJFBBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11ClN2O2/c14-11-8-10(1-2-12(11)17)16-13(18)7-9-3-5-15-6-4-9/h1-6,8,17H,7H2,(H,16,18).
What are the key properties of N-(3-chloro-4-hydroxyphenyl)-2-pyridin-4-ylacetamide?
N-(3-chloro-4-hydroxyphenyl)-2-pyridin-4-ylacetamide has a molecular weight of 262.70 g/mol, XLogP of 2.62, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-4-hydroxyphenyl)-2-pyridin-4-ylacetamide is sourced from PubChem (CID 64787327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).