N-(6-methyl-2-pyridinyl)-N'-(1,2,4-triazol-4-yl)oxamide

C10H10N6O2 — CID 108519128

IUPACN-(6-methyl-2-pyridinyl)-N'-(1,2,4-triazol-4-yl)oxamide
SMILESCc1cccc(NC(=O)C(=O)Nn2cnnc2)n1
InChIInChI=1S/C10H10N6O2/c1-7-3-2-4-8(13-7)14-9(17)10(18)15-16-5-11-12-6-16/h2-6H,1H3,(H,15,18)(H,13,14,17)
InChIKeyLCAKMMJAENEKDZ-UHFFFAOYSA-N
MW246.23 g/mol
LogP-0.31
Rot. Bonds2

About N-(6-methyl-2-pyridinyl)-N'-(1,2,4-triazol-4-yl)oxamide

N-(6-methyl-2-pyridinyl)-N'-(1,2,4-triazol-4-yl)oxamide (PubChem CID 108519128) has the molecular formula C10H10N6O2 and a molecular weight of 246.23 g/mol. Its IUPAC name is N-(6-methyl-2-pyridinyl)-N'-(1,2,4-triazol-4-yl)oxamide.

Molecular Properties

Compound NameN-(6-methyl-2-pyridinyl)-N'-(1,2,4-triazol-4-yl)oxamide
PubChem CID108519128
Molecular FormulaC10H10N6O2
Molecular Weight246.23 g/mol
Exact Mass246.09
IUPAC NameN-(6-methyl-2-pyridinyl)-N'-(1,2,4-triazol-4-yl)oxamide
SMILESCc1cccc(NC(=O)C(=O)Nn2cnnc2)n1
InChIInChI=1S/C10H10N6O2/c1-7-3-2-4-8(13-7)14-9(17)10(18)15-16-5-11-12-6-16/h2-6H,1H3,(H,15,18)(H,13,14,17)
InChIKeyLCAKMMJAENEKDZ-UHFFFAOYSA-N
XLogP-0.31
TPSA101.80 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.23
LogP ≤ 5-0.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

N'-tert-butyl-N-(6-methyl-2-pyridinyl)oxamide
CID 44997660
N-(6-methyl-2-pyridinyl)-N'-propan-2-yloxamide
CID 44997659
N-(2-methylphenyl)-N'-(6-methyl-2-pyridinyl)oxamide
CID 44997672
N-(6-methyl-2-pyridinyl)-N'-(4-methyl-1,3-thiazol-2-yl)oxamide
CID 108519296
N-(3-methyl-2-pyridinyl)-N'-(1,2,4-triazol-4-yl)oxamide
CID 108519230
N-(4-carbamoylphenyl)-N'-(6-methyl-2-pyridinyl)oxamide
CID 108525732
N-[3-(dimethylamino)propyl]-N'-(6-methyl-2-pyridinyl)oxamide
CID 44997594
N-(6-methyl-2-pyridinyl)propanamide
CID 5057760
N-(2-methoxyphenyl)-N'-(6-methyl-2-pyridinyl)oxamide
CID 44997668
N'-(2-hydroxy-5-methylphenyl)-N-(6-methyl-2-pyridinyl)oxamide
CID 108522685
2-ethyl-N-(6-methyl-2-pyridinyl)butanamide
CID 5060766
1-N,4-N-bis(6-methyl-2-pyridinyl)cyclohexane-1,4-dicarboxamide
CID 25469709

Frequently Asked Questions

What is the IUPAC name of N-(6-methyl-2-pyridinyl)-N'-(1,2,4-triazol-4-yl)oxamide?
The IUPAC name of N-(6-methyl-2-pyridinyl)-N'-(1,2,4-triazol-4-yl)oxamide (CID 108519128) is N-(6-methyl-2-pyridinyl)-N'-(1,2,4-triazol-4-yl)oxamide.
What is the SMILES notation for N-(6-methyl-2-pyridinyl)-N'-(1,2,4-triazol-4-yl)oxamide?
The canonical SMILES for N-(6-methyl-2-pyridinyl)-N'-(1,2,4-triazol-4-yl)oxamide is Cc1cccc(NC(=O)C(=O)Nn2cnnc2)n1.
What is the InChIKey of N-(6-methyl-2-pyridinyl)-N'-(1,2,4-triazol-4-yl)oxamide?
The InChIKey is LCAKMMJAENEKDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N6O2/c1-7-3-2-4-8(13-7)14-9(17)10(18)15-16-5-11-12-6-16/h2-6H,1H3,(H,15,18)(H,13,14,17).
What are the key properties of N-(6-methyl-2-pyridinyl)-N'-(1,2,4-triazol-4-yl)oxamide?
N-(6-methyl-2-pyridinyl)-N'-(1,2,4-triazol-4-yl)oxamide has a molecular weight of 246.23 g/mol, XLogP of -0.31, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-methyl-2-pyridinyl)-N'-(1,2,4-triazol-4-yl)oxamide is sourced from PubChem (CID 108519128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).