N-(5-ethyl-1,3-oxazol-2-yl)-5,6,7,8-tetrahydroquinoxaline-2-carboxamide

C14H16N4O2 — CID 166260737

IUPACN-(5-ethyl-1,3-oxazol-2-yl)-5,6,7,8-tetrahydroquinoxaline-2-carboxamide
SMILESCCc1cnc(NC(=O)c2cnc3c(n2)CCCC3)o1
InChIInChI=1S/C14H16N4O2/c1-2-9-7-16-14(20-9)18-13(19)12-8-15-10-5-3-4-6-11(10)17-12/h7-8H,2-6H2,1H3,(H,16,18,19)
InChIKeyGWWCUUYCCPCKKV-UHFFFAOYSA-N
MW272.31 g/mol
LogP2.16
Rot. Bonds3

About N-(5-ethyl-1,3-oxazol-2-yl)-5,6,7,8-tetrahydroquinoxaline-2-carboxamide

N-(5-ethyl-1,3-oxazol-2-yl)-5,6,7,8-tetrahydroquinoxaline-2-carboxamide (PubChem CID 166260737) has the molecular formula C14H16N4O2 and a molecular weight of 272.31 g/mol. Its IUPAC name is N-(5-ethyl-1,3-oxazol-2-yl)-5,6,7,8-tetrahydroquinoxaline-2-carboxamide.

Molecular Properties

Compound NameN-(5-ethyl-1,3-oxazol-2-yl)-5,6,7,8-tetrahydroquinoxaline-2-carboxamide
PubChem CID166260737
Molecular FormulaC14H16N4O2
Molecular Weight272.31 g/mol
Exact Mass272.13
IUPAC NameN-(5-ethyl-1,3-oxazol-2-yl)-5,6,7,8-tetrahydroquinoxaline-2-carboxamide
SMILESCCc1cnc(NC(=O)c2cnc3c(n2)CCCC3)o1
InChIInChI=1S/C14H16N4O2/c1-2-9-7-16-14(20-9)18-13(19)12-8-15-10-5-3-4-6-11(10)17-12/h7-8H,2-6H2,1H3,(H,16,18,19)
InChIKeyGWWCUUYCCPCKKV-UHFFFAOYSA-N
XLogP2.16
TPSA80.91 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.31
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(5-ethyl-1,3-oxazol-2-yl)-5,6,7,8-tetrahydroquinoxaline-2-carboxamide?
The IUPAC name of N-(5-ethyl-1,3-oxazol-2-yl)-5,6,7,8-tetrahydroquinoxaline-2-carboxamide (CID 166260737) is N-(5-ethyl-1,3-oxazol-2-yl)-5,6,7,8-tetrahydroquinoxaline-2-carboxamide.
What is the SMILES notation for N-(5-ethyl-1,3-oxazol-2-yl)-5,6,7,8-tetrahydroquinoxaline-2-carboxamide?
The canonical SMILES for N-(5-ethyl-1,3-oxazol-2-yl)-5,6,7,8-tetrahydroquinoxaline-2-carboxamide is CCc1cnc(NC(=O)c2cnc3c(n2)CCCC3)o1.
What is the InChIKey of N-(5-ethyl-1,3-oxazol-2-yl)-5,6,7,8-tetrahydroquinoxaline-2-carboxamide?
The InChIKey is GWWCUUYCCPCKKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4O2/c1-2-9-7-16-14(20-9)18-13(19)12-8-15-10-5-3-4-6-11(10)17-12/h7-8H,2-6H2,1H3,(H,16,18,19).
What are the key properties of N-(5-ethyl-1,3-oxazol-2-yl)-5,6,7,8-tetrahydroquinoxaline-2-carboxamide?
N-(5-ethyl-1,3-oxazol-2-yl)-5,6,7,8-tetrahydroquinoxaline-2-carboxamide has a molecular weight of 272.31 g/mol, XLogP of 2.16, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-ethyl-1,3-oxazol-2-yl)-5,6,7,8-tetrahydroquinoxaline-2-carboxamide is sourced from PubChem (CID 166260737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).