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

C15H14N4O3 — CID 108530485

IUPACN-(4-carbamoylphenyl)-N'-(4-methyl-2-pyridinyl)oxamide
SMILESCc1ccnc(NC(=O)C(=O)Nc2ccc(C(N)=O)cc2)c1
InChIInChI=1S/C15H14N4O3/c1-9-6-7-17-12(8-9)19-15(22)14(21)18-11-4-2-10(3-5-11)13(16)20/h2-8H,1H3,(H2,16,20)(H,18,21)(H,17,19,22)
InChIKeyLEXXBFMTTKYYHQ-UHFFFAOYSA-N
MW298.30 g/mol
LogP1.07
Rot. Bonds3

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

N-(4-carbamoylphenyl)-N'-(4-methyl-2-pyridinyl)oxamide (PubChem CID 108530485) has the molecular formula C15H14N4O3 and a molecular weight of 298.30 g/mol. Its IUPAC name is N-(4-carbamoylphenyl)-N'-(4-methyl-2-pyridinyl)oxamide.

Molecular Properties

Compound NameN-(4-carbamoylphenyl)-N'-(4-methyl-2-pyridinyl)oxamide
PubChem CID108530485
Molecular FormulaC15H14N4O3
Molecular Weight298.30 g/mol
Exact Mass298.11
IUPAC NameN-(4-carbamoylphenyl)-N'-(4-methyl-2-pyridinyl)oxamide
SMILESCc1ccnc(NC(=O)C(=O)Nc2ccc(C(N)=O)cc2)c1
InChIInChI=1S/C15H14N4O3/c1-9-6-7-17-12(8-9)19-15(22)14(21)18-11-4-2-10(3-5-11)13(16)20/h2-8H,1H3,(H2,16,20)(H,18,21)(H,17,19,22)
InChIKeyLEXXBFMTTKYYHQ-UHFFFAOYSA-N
XLogP1.07
TPSA114.18 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.30
LogP ≤ 51.07
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-[4-(diethylamino)phenyl]-N'-(4-methyl-2-pyridinyl)oxamide
CID 108530624
2-N-(4-methyl-2-pyridinyl)pyridine-2,5-dicarboxamide
CID 47084943
N-(2-carbamoylphenyl)-N'-(4-methyl-2-pyridinyl)oxamide
CID 108529456
4-benzamido-N-(4-methyl-2-pyridinyl)benzamide
CID 17153203
N-[3,5-bis(trifluoromethyl)phenyl]-N'-(4-methyl-2-pyridinyl)oxamide
CID 108530336
1-[3-(4-carbamoylanilino)-3-oxopropyl]-N-(4-methyl-2-pyridinyl)piperidine-4-carboxamide
CID 56525101
N-(4-carbamoylphenyl)-N'-(2-hydroxy-4-methylphenyl)oxamide
CID 108530456
N-(4-carbamoylphenyl)-N'-(6-methyl-2-pyridinyl)oxamide
CID 108525732
N-(2-methylphenyl)-N'-(4-methyl-2-pyridinyl)oxamide
CID 45000004
N-(4-chloro-3-nitrophenyl)-N'-(4-methyl-2-pyridinyl)oxamide
CID 108512860
4-[(2-methyl-4-pyridinyl)amino]benzamide
CID 90134463
1-(4-tert-butylphenyl)-3-(4-methyl-2-pyridinyl)urea
CID 108884892

Frequently Asked Questions

What is the IUPAC name of N-(4-carbamoylphenyl)-N'-(4-methyl-2-pyridinyl)oxamide?
The IUPAC name of N-(4-carbamoylphenyl)-N'-(4-methyl-2-pyridinyl)oxamide (CID 108530485) is N-(4-carbamoylphenyl)-N'-(4-methyl-2-pyridinyl)oxamide.
What is the SMILES notation for N-(4-carbamoylphenyl)-N'-(4-methyl-2-pyridinyl)oxamide?
The canonical SMILES for N-(4-carbamoylphenyl)-N'-(4-methyl-2-pyridinyl)oxamide is Cc1ccnc(NC(=O)C(=O)Nc2ccc(C(N)=O)cc2)c1.
What is the InChIKey of N-(4-carbamoylphenyl)-N'-(4-methyl-2-pyridinyl)oxamide?
The InChIKey is LEXXBFMTTKYYHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O3/c1-9-6-7-17-12(8-9)19-15(22)14(21)18-11-4-2-10(3-5-11)13(16)20/h2-8H,1H3,(H2,16,20)(H,18,21)(H,17,19,22).
What are the key properties of N-(4-carbamoylphenyl)-N'-(4-methyl-2-pyridinyl)oxamide?
N-(4-carbamoylphenyl)-N'-(4-methyl-2-pyridinyl)oxamide has a molecular weight of 298.30 g/mol, XLogP of 1.07, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-carbamoylphenyl)-N'-(4-methyl-2-pyridinyl)oxamide is sourced from PubChem (CID 108530485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).