N'-methyl-N'-(pyridin-2-ylmethyl)oxamide

C9H11N3O2 — CID 115192026

IUPACN'-methyl-N'-(pyridin-2-ylmethyl)oxamide
SMILESCN(Cc1ccccn1)C(=O)C(N)=O
InChIInChI=1S/C9H11N3O2/c1-12(9(14)8(10)13)6-7-4-2-3-5-11-7/h2-5H,6H2,1H3,(H2,10,13)
InChIKeyPZLVRFDIWRNDIN-UHFFFAOYSA-N
MW193.21 g/mol
LogP-0.47
Rot. Bonds2

About N'-methyl-N'-(pyridin-2-ylmethyl)oxamide

N'-methyl-N'-(pyridin-2-ylmethyl)oxamide (PubChem CID 115192026) has the molecular formula C9H11N3O2 and a molecular weight of 193.21 g/mol. Its IUPAC name is N'-methyl-N'-(pyridin-2-ylmethyl)oxamide.

Molecular Properties

Compound NameN'-methyl-N'-(pyridin-2-ylmethyl)oxamide
PubChem CID115192026
Molecular FormulaC9H11N3O2
Molecular Weight193.21 g/mol
Exact Mass193.09
IUPAC NameN'-methyl-N'-(pyridin-2-ylmethyl)oxamide
SMILESCN(Cc1ccccn1)C(=O)C(N)=O
InChIInChI=1S/C9H11N3O2/c1-12(9(14)8(10)13)6-7-4-2-3-5-11-7/h2-5H,6H2,1H3,(H2,10,13)
InChIKeyPZLVRFDIWRNDIN-UHFFFAOYSA-N
XLogP-0.47
TPSA76.29 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.21
LogP ≤ 5-0.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-hydroxy-N,2-dimethyl-N-(pyridin-2-ylmethyl)propanamide
CID 104936654
4-amino-N-methyl-N-(pyridin-2-ylmethyl)benzamide
CID 43564701
1-amino-N-methyl-N-(pyridin-2-ylmethyl)cyclopropane-1-carboxamide
CID 65466995
ethyl 3-[methyl(pyridin-2-ylmethyl)amino]-3-oxopropanoate
CID 115138599
1-hydroxy-1-(pyridin-2-ylmethyl)urea
CID 10374807
4-chloro-N-methyl-N-(pyridin-2-ylmethyl)butanamide
CID 63309527
1-carbamothioyl-N-methyl-N-(pyridin-2-ylmethyl)cyclobutane-1-carboxamide
CID 80589192
6-hydrazinyl-N-methyl-N-(pyridin-2-ylmethyl)pyridazine-3-carboxamide
CID 62243774
N-methyl-N-(pyridin-2-ylmethyl)pyrrolidine-1-carboxamide
CID 115590459
5-chloro-N-methyl-N-(pyridin-2-ylmethyl)pentanamide
CID 43565136
2-(1,3-dioxoisoindol-2-yl)-N-methyl-N-(pyridin-2-ylmethyl)acetamide
CID 87041147
1-[methyl(pyridin-2-ylmethyl)amino]pentan-2-one
CID 62043779

Frequently Asked Questions

What is the IUPAC name of N'-methyl-N'-(pyridin-2-ylmethyl)oxamide?
The IUPAC name of N'-methyl-N'-(pyridin-2-ylmethyl)oxamide (CID 115192026) is N'-methyl-N'-(pyridin-2-ylmethyl)oxamide.
What is the SMILES notation for N'-methyl-N'-(pyridin-2-ylmethyl)oxamide?
The canonical SMILES for N'-methyl-N'-(pyridin-2-ylmethyl)oxamide is CN(Cc1ccccn1)C(=O)C(N)=O.
What is the InChIKey of N'-methyl-N'-(pyridin-2-ylmethyl)oxamide?
The InChIKey is PZLVRFDIWRNDIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3O2/c1-12(9(14)8(10)13)6-7-4-2-3-5-11-7/h2-5H,6H2,1H3,(H2,10,13).
What are the key properties of N'-methyl-N'-(pyridin-2-ylmethyl)oxamide?
N'-methyl-N'-(pyridin-2-ylmethyl)oxamide has a molecular weight of 193.21 g/mol, XLogP of -0.47, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-methyl-N'-(pyridin-2-ylmethyl)oxamide is sourced from PubChem (CID 115192026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).