N'-(5-chloro-1-methyl-6-oxo-3-pyridinyl)-N-cyclopentyloxamide

C13H16ClN3O3 — CID 75477414

IUPACN'-(5-chloro-1-methyl-6-oxo-3-pyridinyl)-N-cyclopentyloxamide
SMILESCn1cc(NC(=O)C(=O)NC2CCCC2)cc(Cl)c1=O
InChIInChI=1S/C13H16ClN3O3/c1-17-7-9(6-10(14)13(17)20)16-12(19)11(18)15-8-4-2-3-5-8/h6-8H,2-5H2,1H3,(H,15,18)(H,16,19)
InChIKeyPUEUZNTVWBCUQH-UHFFFAOYSA-N
MW297.74 g/mol
LogP1.04
Rot. Bonds2

About N'-(5-chloro-1-methyl-6-oxo-3-pyridinyl)-N-cyclopentyloxamide

N'-(5-chloro-1-methyl-6-oxo-3-pyridinyl)-N-cyclopentyloxamide (PubChem CID 75477414) has the molecular formula C13H16ClN3O3 and a molecular weight of 297.74 g/mol. Its IUPAC name is N'-(5-chloro-1-methyl-6-oxo-3-pyridinyl)-N-cyclopentyloxamide.

Molecular Properties

Compound NameN'-(5-chloro-1-methyl-6-oxo-3-pyridinyl)-N-cyclopentyloxamide
PubChem CID75477414
Molecular FormulaC13H16ClN3O3
Molecular Weight297.74 g/mol
Exact Mass297.09
IUPAC NameN'-(5-chloro-1-methyl-6-oxo-3-pyridinyl)-N-cyclopentyloxamide
SMILESCn1cc(NC(=O)C(=O)NC2CCCC2)cc(Cl)c1=O
InChIInChI=1S/C13H16ClN3O3/c1-17-7-9(6-10(14)13(17)20)16-12(19)11(18)15-8-4-2-3-5-8/h6-8H,2-5H2,1H3,(H,15,18)(H,16,19)
InChIKeyPUEUZNTVWBCUQH-UHFFFAOYSA-N
XLogP1.04
TPSA80.20 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.74
LogP ≤ 51.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-cyclopentyl-N'-(3,4-dichlorophenyl)oxamide
CID 2059042
N-cyclohexyl-N'-(3,4-dichlorophenyl)oxamide
CID 2058101
N-cyclopropyl-N'-(3,4-dichlorophenyl)oxamide
CID 2193894
N'-[4-chloro-3-(trifluoromethyl)phenyl]-N-cyclohexyloxamide
CID 108504354
N-cycloheptyl-N'-(4-methylphenyl)oxamide
CID 2287607
N-cyclododecyl-N'-(4-methylphenyl)oxamide
CID 2924110
N-cyclohexyl-N'-phenyloxamide
CID 2271218
N-cyclopentyl-N'-(3,4,5-trimethoxyphenyl)oxamide
CID 108984057
N-cyclopentyl-N'-[4-(4-methylpiperazin-1-yl)phenyl]oxamide
CID 108505990
N'-(4-chloro-2,5-dimethoxyphenyl)-N-cycloheptyloxamide
CID 108530972
N'-(2-chlorophenyl)-N-cyclohexyloxamide
CID 7541659
N-cyclopentyl-N'-(3-hydroxyphenyl)oxamide
CID 44995644

Frequently Asked Questions

What is the IUPAC name of N'-(5-chloro-1-methyl-6-oxo-3-pyridinyl)-N-cyclopentyloxamide?
The IUPAC name of N'-(5-chloro-1-methyl-6-oxo-3-pyridinyl)-N-cyclopentyloxamide (CID 75477414) is N'-(5-chloro-1-methyl-6-oxo-3-pyridinyl)-N-cyclopentyloxamide.
What is the SMILES notation for N'-(5-chloro-1-methyl-6-oxo-3-pyridinyl)-N-cyclopentyloxamide?
The canonical SMILES for N'-(5-chloro-1-methyl-6-oxo-3-pyridinyl)-N-cyclopentyloxamide is Cn1cc(NC(=O)C(=O)NC2CCCC2)cc(Cl)c1=O.
What is the InChIKey of N'-(5-chloro-1-methyl-6-oxo-3-pyridinyl)-N-cyclopentyloxamide?
The InChIKey is PUEUZNTVWBCUQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16ClN3O3/c1-17-7-9(6-10(14)13(17)20)16-12(19)11(18)15-8-4-2-3-5-8/h6-8H,2-5H2,1H3,(H,15,18)(H,16,19).
What are the key properties of N'-(5-chloro-1-methyl-6-oxo-3-pyridinyl)-N-cyclopentyloxamide?
N'-(5-chloro-1-methyl-6-oxo-3-pyridinyl)-N-cyclopentyloxamide has a molecular weight of 297.74 g/mol, XLogP of 1.04, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(5-chloro-1-methyl-6-oxo-3-pyridinyl)-N-cyclopentyloxamide is sourced from PubChem (CID 75477414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).