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

C18H18N4O2 — CID 109232079

IUPAC5-[(5-methyl-1,2-oxazol-3-yl)amino]-N-[(2-methylphenyl)methyl]pyridine-3-carboxamide
SMILESCc1cc(Nc2cncc(C(=O)NCc3ccccc3C)c2)no1
InChIInChI=1S/C18H18N4O2/c1-12-5-3-4-6-14(12)10-20-18(23)15-8-16(11-19-9-15)21-17-7-13(2)24-22-17/h3-9,11H,10H2,1-2H3,(H,20,23)(H,21,22)
InChIKeyJXKZCVDFFGFMLV-UHFFFAOYSA-N
MW322.37 g/mol
LogP3.36
Rot. Bonds5

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

5-[(5-methyl-1,2-oxazol-3-yl)amino]-N-[(2-methylphenyl)methyl]pyridine-3-carboxamide (PubChem CID 109232079) has the molecular formula C18H18N4O2 and a molecular weight of 322.37 g/mol. Its IUPAC name is 5-[(5-methyl-1,2-oxazol-3-yl)amino]-N-[(2-methylphenyl)methyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name5-[(5-methyl-1,2-oxazol-3-yl)amino]-N-[(2-methylphenyl)methyl]pyridine-3-carboxamide
PubChem CID109232079
Molecular FormulaC18H18N4O2
Molecular Weight322.37 g/mol
Exact Mass322.14
IUPAC Name5-[(5-methyl-1,2-oxazol-3-yl)amino]-N-[(2-methylphenyl)methyl]pyridine-3-carboxamide
SMILESCc1cc(Nc2cncc(C(=O)NCc3ccccc3C)c2)no1
InChIInChI=1S/C18H18N4O2/c1-12-5-3-4-6-14(12)10-20-18(23)15-8-16(11-19-9-15)21-17-7-13(2)24-22-17/h3-9,11H,10H2,1-2H3,(H,20,23)(H,21,22)
InChIKeyJXKZCVDFFGFMLV-UHFFFAOYSA-N
XLogP3.36
TPSA80.05 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.37
LogP ≤ 53.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-N-(5-methyl-1,2-oxazol-3-yl)-3-N-[(2-methylphenyl)methyl]pyridine-3,5-dicarboxamide
CID 109105168
5-[(5-methyl-1,2-oxazol-3-yl)amino]-N-(pyridin-2-ylmethyl)pyridine-3-carboxamide
CID 109235057
5-[(5-methyl-1,2-oxazol-3-yl)amino]-N-(2-methylphenyl)pyridine-3-carboxamide
CID 109241732
5-(3-acetamidoanilino)-N-[(2-methylphenyl)methyl]pyridine-3-carboxamide
CID 109232047
5-(2-ethyl-6-methylanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide
CID 109243738
5-(4-cyanoanilino)-N-[(2-methylphenyl)methyl]pyridine-3-carboxamide
CID 109232074
N-(3-methylbutyl)-5-[(5-methyl-1,2-oxazol-3-yl)amino]pyridine-3-carboxamide
CID 109239896
6-[(5-methyl-1,2-oxazol-3-yl)amino]-N-[(2-methylphenyl)methyl]pyrimidine-4-carboxamide
CID 109347017
5-(2,6-diethylanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide
CID 109243974
4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]-N-[(2-methylphenyl)methyl]benzamide
CID 109060619
5-(cycloheptylamino)-N-[(2-methylphenyl)methyl]pyridine-3-carboxamide
CID 109231985
N-[2-(4-chlorophenyl)ethyl]-5-[(5-methyl-1,2-oxazol-3-yl)amino]pyridine-3-carboxamide
CID 109237830

Frequently Asked Questions

What is the IUPAC name of 5-[(5-methyl-1,2-oxazol-3-yl)amino]-N-[(2-methylphenyl)methyl]pyridine-3-carboxamide?
The IUPAC name of 5-[(5-methyl-1,2-oxazol-3-yl)amino]-N-[(2-methylphenyl)methyl]pyridine-3-carboxamide (CID 109232079) is 5-[(5-methyl-1,2-oxazol-3-yl)amino]-N-[(2-methylphenyl)methyl]pyridine-3-carboxamide.
What is the SMILES notation for 5-[(5-methyl-1,2-oxazol-3-yl)amino]-N-[(2-methylphenyl)methyl]pyridine-3-carboxamide?
The canonical SMILES for 5-[(5-methyl-1,2-oxazol-3-yl)amino]-N-[(2-methylphenyl)methyl]pyridine-3-carboxamide is Cc1cc(Nc2cncc(C(=O)NCc3ccccc3C)c2)no1.
What is the InChIKey of 5-[(5-methyl-1,2-oxazol-3-yl)amino]-N-[(2-methylphenyl)methyl]pyridine-3-carboxamide?
The InChIKey is JXKZCVDFFGFMLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N4O2/c1-12-5-3-4-6-14(12)10-20-18(23)15-8-16(11-19-9-15)21-17-7-13(2)24-22-17/h3-9,11H,10H2,1-2H3,(H,20,23)(H,21,22).
What are the key properties of 5-[(5-methyl-1,2-oxazol-3-yl)amino]-N-[(2-methylphenyl)methyl]pyridine-3-carboxamide?
5-[(5-methyl-1,2-oxazol-3-yl)amino]-N-[(2-methylphenyl)methyl]pyridine-3-carboxamide has a molecular weight of 322.37 g/mol, XLogP of 3.36, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(5-methyl-1,2-oxazol-3-yl)amino]-N-[(2-methylphenyl)methyl]pyridine-3-carboxamide is sourced from PubChem (CID 109232079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).