5-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-N-methylpyridine-2,5-dicarboxamide

C14H16N4O3 — CID 75462392

IUPAC5-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-N-methylpyridine-2,5-dicarboxamide
SMILESCc1noc(C)c1CN(C)C(=O)c1ccc(C(N)=O)nc1
InChIInChI=1S/C14H16N4O3/c1-8-11(9(2)21-17-8)7-18(3)14(20)10-4-5-12(13(15)19)16-6-10/h4-6H,7H2,1-3H3,(H2,15,19)
InChIKeyKATYHEXQCQKJGH-UHFFFAOYSA-N
MW288.31 g/mol
LogP1.06
Rot. Bonds4

About 5-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-N-methylpyridine-2,5-dicarboxamide

5-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-N-methylpyridine-2,5-dicarboxamide (PubChem CID 75462392) has the molecular formula C14H16N4O3 and a molecular weight of 288.31 g/mol. Its IUPAC name is 5-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-N-methylpyridine-2,5-dicarboxamide.

Molecular Properties

Compound Name5-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-N-methylpyridine-2,5-dicarboxamide
PubChem CID75462392
Molecular FormulaC14H16N4O3
Molecular Weight288.31 g/mol
Exact Mass288.12
IUPAC Name5-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-N-methylpyridine-2,5-dicarboxamide
SMILESCc1noc(C)c1CN(C)C(=O)c1ccc(C(N)=O)nc1
InChIInChI=1S/C14H16N4O3/c1-8-11(9(2)21-17-8)7-18(3)14(20)10-4-5-12(13(15)19)16-6-10/h4-6H,7H2,1-3H3,(H2,15,19)
InChIKeyKATYHEXQCQKJGH-UHFFFAOYSA-N
XLogP1.06
TPSA102.32 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.31
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-N-methylpyridine-2,5-dicarboxamide?
The IUPAC name of 5-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-N-methylpyridine-2,5-dicarboxamide (CID 75462392) is 5-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-N-methylpyridine-2,5-dicarboxamide.
What is the SMILES notation for 5-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-N-methylpyridine-2,5-dicarboxamide?
The canonical SMILES for 5-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-N-methylpyridine-2,5-dicarboxamide is Cc1noc(C)c1CN(C)C(=O)c1ccc(C(N)=O)nc1.
What is the InChIKey of 5-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-N-methylpyridine-2,5-dicarboxamide?
The InChIKey is KATYHEXQCQKJGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4O3/c1-8-11(9(2)21-17-8)7-18(3)14(20)10-4-5-12(13(15)19)16-6-10/h4-6H,7H2,1-3H3,(H2,15,19).
What are the key properties of 5-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-N-methylpyridine-2,5-dicarboxamide?
5-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-N-methylpyridine-2,5-dicarboxamide has a molecular weight of 288.31 g/mol, XLogP of 1.06, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-N-methylpyridine-2,5-dicarboxamide is sourced from PubChem (CID 75462392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).