2-ethyl-N-(1,2-oxazol-5-ylmethyl)-6-(propylamino)pyridine-4-carboxamide

C15H20N4O2 — CID 106423091

IUPAC2-ethyl-N-(1,2-oxazol-5-ylmethyl)-6-(propylamino)pyridine-4-carboxamide
SMILESCCCNc1cc(C(=O)NCc2ccno2)cc(CC)n1
InChIInChI=1S/C15H20N4O2/c1-3-6-16-14-9-11(8-12(4-2)19-14)15(20)17-10-13-5-7-18-21-13/h5,7-9H,3-4,6,10H2,1-2H3,(H,16,19)(H,17,20)
InChIKeyUXOUFODQFONSOT-UHFFFAOYSA-N
MW288.35 g/mol
LogP2.38
Rot. Bonds7

About 2-ethyl-N-(1,2-oxazol-5-ylmethyl)-6-(propylamino)pyridine-4-carboxamide

2-ethyl-N-(1,2-oxazol-5-ylmethyl)-6-(propylamino)pyridine-4-carboxamide (PubChem CID 106423091) has the molecular formula C15H20N4O2 and a molecular weight of 288.35 g/mol. Its IUPAC name is 2-ethyl-N-(1,2-oxazol-5-ylmethyl)-6-(propylamino)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-ethyl-N-(1,2-oxazol-5-ylmethyl)-6-(propylamino)pyridine-4-carboxamide
PubChem CID106423091
Molecular FormulaC15H20N4O2
Molecular Weight288.35 g/mol
Exact Mass288.16
IUPAC Name2-ethyl-N-(1,2-oxazol-5-ylmethyl)-6-(propylamino)pyridine-4-carboxamide
SMILESCCCNc1cc(C(=O)NCc2ccno2)cc(CC)n1
InChIInChI=1S/C15H20N4O2/c1-3-6-16-14-9-11(8-12(4-2)19-14)15(20)17-10-13-5-7-18-21-13/h5,7-9H,3-4,6,10H2,1-2H3,(H,16,19)(H,17,20)
InChIKeyUXOUFODQFONSOT-UHFFFAOYSA-N
XLogP2.38
TPSA80.05 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 52.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-(1,2-oxazol-5-ylmethyl)-6-(propylamino)pyridine-4-carboxamide?
The IUPAC name of 2-ethyl-N-(1,2-oxazol-5-ylmethyl)-6-(propylamino)pyridine-4-carboxamide (CID 106423091) is 2-ethyl-N-(1,2-oxazol-5-ylmethyl)-6-(propylamino)pyridine-4-carboxamide.
What is the SMILES notation for 2-ethyl-N-(1,2-oxazol-5-ylmethyl)-6-(propylamino)pyridine-4-carboxamide?
The canonical SMILES for 2-ethyl-N-(1,2-oxazol-5-ylmethyl)-6-(propylamino)pyridine-4-carboxamide is CCCNc1cc(C(=O)NCc2ccno2)cc(CC)n1.
What is the InChIKey of 2-ethyl-N-(1,2-oxazol-5-ylmethyl)-6-(propylamino)pyridine-4-carboxamide?
The InChIKey is UXOUFODQFONSOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O2/c1-3-6-16-14-9-11(8-12(4-2)19-14)15(20)17-10-13-5-7-18-21-13/h5,7-9H,3-4,6,10H2,1-2H3,(H,16,19)(H,17,20).
What are the key properties of 2-ethyl-N-(1,2-oxazol-5-ylmethyl)-6-(propylamino)pyridine-4-carboxamide?
2-ethyl-N-(1,2-oxazol-5-ylmethyl)-6-(propylamino)pyridine-4-carboxamide has a molecular weight of 288.35 g/mol, XLogP of 2.38, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-(1,2-oxazol-5-ylmethyl)-6-(propylamino)pyridine-4-carboxamide is sourced from PubChem (CID 106423091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).