N-(5-methyl-1,2-oxazol-3-yl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)propanamide

C15H20N6O2 — CID 42897604

IUPACN-(5-methyl-1,2-oxazol-3-yl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)propanamide
SMILESCc1cc(NC(=O)C(C)N2CCN(c3ncccn3)CC2)no1
InChIInChI=1S/C15H20N6O2/c1-11-10-13(19-23-11)18-14(22)12(2)20-6-8-21(9-7-20)15-16-4-3-5-17-15/h3-5,10,12H,6-9H2,1-2H3,(H,18,19,22)
InChIKeyWTEQOLXZNSGRAC-UHFFFAOYSA-N
MW316.37 g/mol
LogP0.92
Rot. Bonds4

About N-(5-methyl-1,2-oxazol-3-yl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)propanamide

N-(5-methyl-1,2-oxazol-3-yl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)propanamide (PubChem CID 42897604) has the molecular formula C15H20N6O2 and a molecular weight of 316.37 g/mol. Its IUPAC name is N-(5-methyl-1,2-oxazol-3-yl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)propanamide.

Molecular Properties

Compound NameN-(5-methyl-1,2-oxazol-3-yl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)propanamide
PubChem CID42897604
Molecular FormulaC15H20N6O2
Molecular Weight316.37 g/mol
Exact Mass316.16
IUPAC NameN-(5-methyl-1,2-oxazol-3-yl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)propanamide
SMILESCc1cc(NC(=O)C(C)N2CCN(c3ncccn3)CC2)no1
InChIInChI=1S/C15H20N6O2/c1-11-10-13(19-23-11)18-14(22)12(2)20-6-8-21(9-7-20)15-16-4-3-5-17-15/h3-5,10,12H,6-9H2,1-2H3,(H,18,19,22)
InChIKeyWTEQOLXZNSGRAC-UHFFFAOYSA-N
XLogP0.92
TPSA87.39 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.37
LogP ≤ 50.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-(5-methyl-1,2-oxazol-3-yl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)propanamide?
The IUPAC name of N-(5-methyl-1,2-oxazol-3-yl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)propanamide (CID 42897604) is N-(5-methyl-1,2-oxazol-3-yl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)propanamide.
What is the SMILES notation for N-(5-methyl-1,2-oxazol-3-yl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)propanamide?
The canonical SMILES for N-(5-methyl-1,2-oxazol-3-yl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)propanamide is Cc1cc(NC(=O)C(C)N2CCN(c3ncccn3)CC2)no1.
What is the InChIKey of N-(5-methyl-1,2-oxazol-3-yl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)propanamide?
The InChIKey is WTEQOLXZNSGRAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N6O2/c1-11-10-13(19-23-11)18-14(22)12(2)20-6-8-21(9-7-20)15-16-4-3-5-17-15/h3-5,10,12H,6-9H2,1-2H3,(H,18,19,22).
What are the key properties of N-(5-methyl-1,2-oxazol-3-yl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)propanamide?
N-(5-methyl-1,2-oxazol-3-yl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)propanamide has a molecular weight of 316.37 g/mol, XLogP of 0.92, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-1,2-oxazol-3-yl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)propanamide is sourced from PubChem (CID 42897604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).