N'-[4-(2-oxopiperidin-1-yl)benzoyl]pyridine-2-carbohydrazide

C18H18N4O3 — CID 18108449

IUPACN'-[4-(2-oxopiperidin-1-yl)benzoyl]pyridine-2-carbohydrazide
SMILESO=C(NNC(=O)c1ccccn1)c1ccc(N2CCCCC2=O)cc1
InChIInChI=1S/C18H18N4O3/c23-16-6-2-4-12-22(16)14-9-7-13(8-10-14)17(24)20-21-18(25)15-5-1-3-11-19-15/h1,3,5,7-11H,2,4,6,12H2,(H,20,24)(H,21,25)
InChIKeyAILUVQWHSIBQMW-UHFFFAOYSA-N
MW338.37 g/mol
LogP1.67
Rot. Bonds3

About N'-[4-(2-oxopiperidin-1-yl)benzoyl]pyridine-2-carbohydrazide

N'-[4-(2-oxopiperidin-1-yl)benzoyl]pyridine-2-carbohydrazide (PubChem CID 18108449) has the molecular formula C18H18N4O3 and a molecular weight of 338.37 g/mol. Its IUPAC name is N'-[4-(2-oxopiperidin-1-yl)benzoyl]pyridine-2-carbohydrazide.

Molecular Properties

Compound NameN'-[4-(2-oxopiperidin-1-yl)benzoyl]pyridine-2-carbohydrazide
PubChem CID18108449
Molecular FormulaC18H18N4O3
Molecular Weight338.37 g/mol
Exact Mass338.14
IUPAC NameN'-[4-(2-oxopiperidin-1-yl)benzoyl]pyridine-2-carbohydrazide
SMILESO=C(NNC(=O)c1ccccn1)c1ccc(N2CCCCC2=O)cc1
InChIInChI=1S/C18H18N4O3/c23-16-6-2-4-12-22(16)14-9-7-13(8-10-14)17(24)20-21-18(25)15-5-1-3-11-19-15/h1,3,5,7-11H,2,4,6,12H2,(H,20,24)(H,21,25)
InChIKeyAILUVQWHSIBQMW-UHFFFAOYSA-N
XLogP1.67
TPSA91.40 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.37
LogP ≤ 51.67
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-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]pyridine-2-carboxamide
CID 8588320
4-(2-oxopyrrolidin-1-yl)-N-[(Z)-1-pyridin-2-ylethylideneamino]benzamide
CID 5406284
2-fluoro-N'-[4-(2-oxopiperidin-1-yl)benzoyl]benzohydrazide
CID 31794745
2-methyl-N'-[4-(2-oxopiperidin-1-yl)benzoyl]imidazo[1,2-a]pyridine-3-carbohydrazide
CID 24514111
3-(dimethylamino)-N'-[4-(2-oxopiperidin-1-yl)benzoyl]benzohydrazide
CID 35768592
N-[3-methyl-5-(2-pyridin-2-ylethynyl)phenyl]-4-(2-oxopiperidin-1-yl)benzamide
CID 168957701
N'-[2-(4-chlorophenyl)acetyl]-4-(2-oxopyrrolidin-1-yl)benzohydrazide
CID 26657735
N-(benzimidazol-1-yl)-4-(2-oxopiperidin-1-yl)benzamide
CID 17417580
4-(2-oxopyrrolidin-1-yl)-N-[2-(pyrimidin-2-ylamino)ethyl]benzamide
CID 51081174
N-cyclopropyl-4-(2-oxopiperidin-1-yl)benzamide
CID 18105948
N-methoxy-4-(2-oxopiperidin-1-yl)benzamide
CID 51279408
N-(4-chlorophenyl)-4-(2-oxopiperidin-1-yl)benzamide
CID 36678322

Frequently Asked Questions

What is the IUPAC name of N'-[4-(2-oxopiperidin-1-yl)benzoyl]pyridine-2-carbohydrazide?
The IUPAC name of N'-[4-(2-oxopiperidin-1-yl)benzoyl]pyridine-2-carbohydrazide (CID 18108449) is N'-[4-(2-oxopiperidin-1-yl)benzoyl]pyridine-2-carbohydrazide.
What is the SMILES notation for N'-[4-(2-oxopiperidin-1-yl)benzoyl]pyridine-2-carbohydrazide?
The canonical SMILES for N'-[4-(2-oxopiperidin-1-yl)benzoyl]pyridine-2-carbohydrazide is O=C(NNC(=O)c1ccccn1)c1ccc(N2CCCCC2=O)cc1.
What is the InChIKey of N'-[4-(2-oxopiperidin-1-yl)benzoyl]pyridine-2-carbohydrazide?
The InChIKey is AILUVQWHSIBQMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N4O3/c23-16-6-2-4-12-22(16)14-9-7-13(8-10-14)17(24)20-21-18(25)15-5-1-3-11-19-15/h1,3,5,7-11H,2,4,6,12H2,(H,20,24)(H,21,25).
What are the key properties of N'-[4-(2-oxopiperidin-1-yl)benzoyl]pyridine-2-carbohydrazide?
N'-[4-(2-oxopiperidin-1-yl)benzoyl]pyridine-2-carbohydrazide has a molecular weight of 338.37 g/mol, XLogP of 1.67, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[4-(2-oxopiperidin-1-yl)benzoyl]pyridine-2-carbohydrazide is sourced from PubChem (CID 18108449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).