N-(3-chlorophenyl)-N-[4-(hydroxyamino)-2-pyridinyl]acetamide

C13H12ClN3O2 — CID 166927724

IUPACN-(3-chlorophenyl)-N-[4-(hydroxyamino)-2-pyridinyl]acetamide
SMILESCC(=O)N(c1cccc(Cl)c1)c1cc(NO)ccn1
InChIInChI=1S/C13H12ClN3O2/c1-9(18)17(12-4-2-3-10(14)7-12)13-8-11(16-19)5-6-15-13/h2-8,19H,1H3,(H,15,16)
InChIKeyPRYNUUDCUIANPV-UHFFFAOYSA-N
MW277.71 g/mol
LogP3.22
Rot. Bonds3

About N-(3-chlorophenyl)-N-[4-(hydroxyamino)-2-pyridinyl]acetamide

N-(3-chlorophenyl)-N-[4-(hydroxyamino)-2-pyridinyl]acetamide (PubChem CID 166927724) has the molecular formula C13H12ClN3O2 and a molecular weight of 277.71 g/mol. Its IUPAC name is N-(3-chlorophenyl)-N-[4-(hydroxyamino)-2-pyridinyl]acetamide.

Molecular Properties

Compound NameN-(3-chlorophenyl)-N-[4-(hydroxyamino)-2-pyridinyl]acetamide
PubChem CID166927724
Molecular FormulaC13H12ClN3O2
Molecular Weight277.71 g/mol
Exact Mass277.06
IUPAC NameN-(3-chlorophenyl)-N-[4-(hydroxyamino)-2-pyridinyl]acetamide
SMILESCC(=O)N(c1cccc(Cl)c1)c1cc(NO)ccn1
InChIInChI=1S/C13H12ClN3O2/c1-9(18)17(12-4-2-3-10(14)7-12)13-8-11(16-19)5-6-15-13/h2-8,19H,1H3,(H,15,16)
InChIKeyPRYNUUDCUIANPV-UHFFFAOYSA-N
XLogP3.22
TPSA65.46 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.71
LogP ≤ 53.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-(3-chlorophenyl)-N-[4-(oxidoamino)-2-pyridinyl]acetamide
CID 169022950
N-(4-fluoro-3-methoxyphenyl)-N-[4-(hydroxyamino)-2-pyridinyl]acetamide
CID 170189482
N-(3-chloro-4-methylphenyl)-N-[4-(oxidoamino)-2-pyridinyl]acetamide
CID 169022993
N-[2-[acetyl(pyridin-4-yl)amino]-4-pyridinyl]-2-(2,6-dichlorophenyl)acetamide
CID 162746510
N-[2-(N-acetyl-3-fluoroanilino)-4-pyridinyl]-2-(2-chloro-4-fluorophenyl)acetamide;N-[2-(N-acetyl-3-fluoroanilino)-4-pyridinyl]-2-(2-chlorophenyl)acetamide
CID 175417454
N-imidazo[1,2-a]pyridin-7-yl-N-[4-(oxidoamino)-2-pyridinyl]acetamide
CID 162746889
N-[2-[acetyl(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-4-pyridinyl]-2-(2,6-dichlorophenyl)acetamide
CID 162746745
N-isoquinolin-6-yl-N-[4-(methylamino)-2-pyridinyl]acetamide
CID 162746574
N-(3-fluorophenyl)-N-(4-nitroso-2-pyridinyl)acetamide
CID 169022978
N-(3-chlorophenyl)-N-hydroxyacetamide
CID 13158205
N-[2-(N-acetyl-3,4-difluoroanilino)-4-pyridinyl]-2-(2,6-dichloro-4-ethylphenyl)acetamide
CID 162428154
N-[2-[acetyl-(2-methylbenzotriazol-5-yl)amino]-4-pyridinyl]-2-(2-chloro-3-fluorophenyl)acetamide
CID 162746556

Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-N-[4-(hydroxyamino)-2-pyridinyl]acetamide?
The IUPAC name of N-(3-chlorophenyl)-N-[4-(hydroxyamino)-2-pyridinyl]acetamide (CID 166927724) is N-(3-chlorophenyl)-N-[4-(hydroxyamino)-2-pyridinyl]acetamide.
What is the SMILES notation for N-(3-chlorophenyl)-N-[4-(hydroxyamino)-2-pyridinyl]acetamide?
The canonical SMILES for N-(3-chlorophenyl)-N-[4-(hydroxyamino)-2-pyridinyl]acetamide is CC(=O)N(c1cccc(Cl)c1)c1cc(NO)ccn1.
What is the InChIKey of N-(3-chlorophenyl)-N-[4-(hydroxyamino)-2-pyridinyl]acetamide?
The InChIKey is PRYNUUDCUIANPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12ClN3O2/c1-9(18)17(12-4-2-3-10(14)7-12)13-8-11(16-19)5-6-15-13/h2-8,19H,1H3,(H,15,16).
What are the key properties of N-(3-chlorophenyl)-N-[4-(hydroxyamino)-2-pyridinyl]acetamide?
N-(3-chlorophenyl)-N-[4-(hydroxyamino)-2-pyridinyl]acetamide has a molecular weight of 277.71 g/mol, XLogP of 3.22, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)-N-[4-(hydroxyamino)-2-pyridinyl]acetamide is sourced from PubChem (CID 166927724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).