5-N-(5-methyl-1,2-oxazol-3-yl)-3-N-[(2-methylphenyl)methyl]pyridine-3,5-dicarboxamide

C19H18N4O3 — CID 109105168

IUPAC5-N-(5-methyl-1,2-oxazol-3-yl)-3-N-[(2-methylphenyl)methyl]pyridine-3,5-dicarboxamide
SMILESCc1cc(NC(=O)c2cncc(C(=O)NCc3ccccc3C)c2)no1
InChIInChI=1S/C19H18N4O3/c1-12-5-3-4-6-14(12)11-21-18(24)15-8-16(10-20-9-15)19(25)22-17-7-13(2)26-23-17/h3-10H,11H2,1-2H3,(H,21,24)(H,22,23,25)
InChIKeyPYFPWKDSZKDIQM-UHFFFAOYSA-N
MW350.38 g/mol
LogP2.87
Rot. Bonds5

About 5-N-(5-methyl-1,2-oxazol-3-yl)-3-N-[(2-methylphenyl)methyl]pyridine-3,5-dicarboxamide

5-N-(5-methyl-1,2-oxazol-3-yl)-3-N-[(2-methylphenyl)methyl]pyridine-3,5-dicarboxamide (PubChem CID 109105168) has the molecular formula C19H18N4O3 and a molecular weight of 350.38 g/mol. Its IUPAC name is 5-N-(5-methyl-1,2-oxazol-3-yl)-3-N-[(2-methylphenyl)methyl]pyridine-3,5-dicarboxamide.

Molecular Properties

Compound Name5-N-(5-methyl-1,2-oxazol-3-yl)-3-N-[(2-methylphenyl)methyl]pyridine-3,5-dicarboxamide
PubChem CID109105168
Molecular FormulaC19H18N4O3
Molecular Weight350.38 g/mol
Exact Mass350.14
IUPAC Name5-N-(5-methyl-1,2-oxazol-3-yl)-3-N-[(2-methylphenyl)methyl]pyridine-3,5-dicarboxamide
SMILESCc1cc(NC(=O)c2cncc(C(=O)NCc3ccccc3C)c2)no1
InChIInChI=1S/C19H18N4O3/c1-12-5-3-4-6-14(12)11-21-18(24)15-8-16(10-20-9-15)19(25)22-17-7-13(2)26-23-17/h3-10H,11H2,1-2H3,(H,21,24)(H,22,23,25)
InChIKeyPYFPWKDSZKDIQM-UHFFFAOYSA-N
XLogP2.87
TPSA97.12 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.38
LogP ≤ 52.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-N-(5-methyl-1,2-oxazol-3-yl)-3-N-[(2-methylphenyl)methyl]pyridine-3,5-dicarboxamide?
The IUPAC name of 5-N-(5-methyl-1,2-oxazol-3-yl)-3-N-[(2-methylphenyl)methyl]pyridine-3,5-dicarboxamide (CID 109105168) is 5-N-(5-methyl-1,2-oxazol-3-yl)-3-N-[(2-methylphenyl)methyl]pyridine-3,5-dicarboxamide.
What is the SMILES notation for 5-N-(5-methyl-1,2-oxazol-3-yl)-3-N-[(2-methylphenyl)methyl]pyridine-3,5-dicarboxamide?
The canonical SMILES for 5-N-(5-methyl-1,2-oxazol-3-yl)-3-N-[(2-methylphenyl)methyl]pyridine-3,5-dicarboxamide is Cc1cc(NC(=O)c2cncc(C(=O)NCc3ccccc3C)c2)no1.
What is the InChIKey of 5-N-(5-methyl-1,2-oxazol-3-yl)-3-N-[(2-methylphenyl)methyl]pyridine-3,5-dicarboxamide?
The InChIKey is PYFPWKDSZKDIQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4O3/c1-12-5-3-4-6-14(12)11-21-18(24)15-8-16(10-20-9-15)19(25)22-17-7-13(2)26-23-17/h3-10H,11H2,1-2H3,(H,21,24)(H,22,23,25).
What are the key properties of 5-N-(5-methyl-1,2-oxazol-3-yl)-3-N-[(2-methylphenyl)methyl]pyridine-3,5-dicarboxamide?
5-N-(5-methyl-1,2-oxazol-3-yl)-3-N-[(2-methylphenyl)methyl]pyridine-3,5-dicarboxamide has a molecular weight of 350.38 g/mol, XLogP of 2.87, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-(5-methyl-1,2-oxazol-3-yl)-3-N-[(2-methylphenyl)methyl]pyridine-3,5-dicarboxamide is sourced from PubChem (CID 109105168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).