N-[6-amino-5-(2-chlorophenyl)pyrazin-2-yl]-1,2-oxazole-3-carboxamide

C14H10ClN5O2 — CID 67396749

IUPACN-[6-amino-5-(2-chlorophenyl)pyrazin-2-yl]-1,2-oxazole-3-carboxamide
SMILESNc1nc(NC(=O)c2ccon2)cnc1-c1ccccc1Cl
InChIInChI=1S/C14H10ClN5O2/c15-9-4-2-1-3-8(9)12-13(16)18-11(7-17-12)19-14(21)10-5-6-22-20-10/h1-7H,(H3,16,18,19,21)
InChIKeyVXJMRTVSIXXURP-UHFFFAOYSA-N
MW315.72 g/mol
LogP2.62
Rot. Bonds3

About N-[6-amino-5-(2-chlorophenyl)pyrazin-2-yl]-1,2-oxazole-3-carboxamide

N-[6-amino-5-(2-chlorophenyl)pyrazin-2-yl]-1,2-oxazole-3-carboxamide (PubChem CID 67396749) has the molecular formula C14H10ClN5O2 and a molecular weight of 315.72 g/mol. Its IUPAC name is N-[6-amino-5-(2-chlorophenyl)pyrazin-2-yl]-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-[6-amino-5-(2-chlorophenyl)pyrazin-2-yl]-1,2-oxazole-3-carboxamide
PubChem CID67396749
Molecular FormulaC14H10ClN5O2
Molecular Weight315.72 g/mol
Exact Mass315.05
IUPAC NameN-[6-amino-5-(2-chlorophenyl)pyrazin-2-yl]-1,2-oxazole-3-carboxamide
SMILESNc1nc(NC(=O)c2ccon2)cnc1-c1ccccc1Cl
InChIInChI=1S/C14H10ClN5O2/c15-9-4-2-1-3-8(9)12-13(16)18-11(7-17-12)19-14(21)10-5-6-22-20-10/h1-7H,(H3,16,18,19,21)
InChIKeyVXJMRTVSIXXURP-UHFFFAOYSA-N
XLogP2.62
TPSA106.93 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.72
LogP ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[6-amino-5-(2-chlorophenyl)pyrazin-2-yl]-1,2-oxazole-3-carboxamide?
The IUPAC name of N-[6-amino-5-(2-chlorophenyl)pyrazin-2-yl]-1,2-oxazole-3-carboxamide (CID 67396749) is N-[6-amino-5-(2-chlorophenyl)pyrazin-2-yl]-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-[6-amino-5-(2-chlorophenyl)pyrazin-2-yl]-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-[6-amino-5-(2-chlorophenyl)pyrazin-2-yl]-1,2-oxazole-3-carboxamide is Nc1nc(NC(=O)c2ccon2)cnc1-c1ccccc1Cl.
What is the InChIKey of N-[6-amino-5-(2-chlorophenyl)pyrazin-2-yl]-1,2-oxazole-3-carboxamide?
The InChIKey is VXJMRTVSIXXURP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10ClN5O2/c15-9-4-2-1-3-8(9)12-13(16)18-11(7-17-12)19-14(21)10-5-6-22-20-10/h1-7H,(H3,16,18,19,21).
What are the key properties of N-[6-amino-5-(2-chlorophenyl)pyrazin-2-yl]-1,2-oxazole-3-carboxamide?
N-[6-amino-5-(2-chlorophenyl)pyrazin-2-yl]-1,2-oxazole-3-carboxamide has a molecular weight of 315.72 g/mol, XLogP of 2.62, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-amino-5-(2-chlorophenyl)pyrazin-2-yl]-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 67396749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).