N-(2-methoxyphenyl)-N'-(4-methyl-2-pyridinyl)oxamide

C15H15N3O3 — CID 45000000

IUPACN-(2-methoxyphenyl)-N'-(4-methyl-2-pyridinyl)oxamide
SMILESCOc1ccccc1NC(=O)C(=O)Nc1cc(C)ccn1
InChIInChI=1S/C15H15N3O3/c1-10-7-8-16-13(9-10)18-15(20)14(19)17-11-5-3-4-6-12(11)21-2/h3-9H,1-2H3,(H,17,19)(H,16,18,20)
InChIKeyPPKXJJHTHGYCGI-UHFFFAOYSA-N
MW285.30 g/mol
LogP1.98
Rot. Bonds3

About N-(2-methoxyphenyl)-N'-(4-methyl-2-pyridinyl)oxamide

N-(2-methoxyphenyl)-N'-(4-methyl-2-pyridinyl)oxamide (PubChem CID 45000000) has the molecular formula C15H15N3O3 and a molecular weight of 285.30 g/mol. Its IUPAC name is N-(2-methoxyphenyl)-N'-(4-methyl-2-pyridinyl)oxamide.

Molecular Properties

Compound NameN-(2-methoxyphenyl)-N'-(4-methyl-2-pyridinyl)oxamide
PubChem CID45000000
Molecular FormulaC15H15N3O3
Molecular Weight285.30 g/mol
Exact Mass285.11
IUPAC NameN-(2-methoxyphenyl)-N'-(4-methyl-2-pyridinyl)oxamide
SMILESCOc1ccccc1NC(=O)C(=O)Nc1cc(C)ccn1
InChIInChI=1S/C15H15N3O3/c1-10-7-8-16-13(9-10)18-15(20)14(19)17-11-5-3-4-6-12(11)21-2/h3-9H,1-2H3,(H,17,19)(H,16,18,20)
InChIKeyPPKXJJHTHGYCGI-UHFFFAOYSA-N
XLogP1.98
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.30
LogP ≤ 51.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyphenyl)-N'-(4-methyl-2-pyridinyl)oxamide?
The IUPAC name of N-(2-methoxyphenyl)-N'-(4-methyl-2-pyridinyl)oxamide (CID 45000000) is N-(2-methoxyphenyl)-N'-(4-methyl-2-pyridinyl)oxamide.
What is the SMILES notation for N-(2-methoxyphenyl)-N'-(4-methyl-2-pyridinyl)oxamide?
The canonical SMILES for N-(2-methoxyphenyl)-N'-(4-methyl-2-pyridinyl)oxamide is COc1ccccc1NC(=O)C(=O)Nc1cc(C)ccn1.
What is the InChIKey of N-(2-methoxyphenyl)-N'-(4-methyl-2-pyridinyl)oxamide?
The InChIKey is PPKXJJHTHGYCGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O3/c1-10-7-8-16-13(9-10)18-15(20)14(19)17-11-5-3-4-6-12(11)21-2/h3-9H,1-2H3,(H,17,19)(H,16,18,20).
What are the key properties of N-(2-methoxyphenyl)-N'-(4-methyl-2-pyridinyl)oxamide?
N-(2-methoxyphenyl)-N'-(4-methyl-2-pyridinyl)oxamide has a molecular weight of 285.30 g/mol, XLogP of 1.98, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyphenyl)-N'-(4-methyl-2-pyridinyl)oxamide is sourced from PubChem (CID 45000000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).