N-ethyl-N-(1-ethyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)acetamide

C15H17N5O — CID 13385732

IUPACN-ethyl-N-(1-ethyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)acetamide
SMILESCCc1nnc2c(N(CC)C(C)=O)nc3ccccc3n12
InChIInChI=1S/C15H17N5O/c1-4-13-17-18-15-14(19(5-2)10(3)21)16-11-8-6-7-9-12(11)20(13)15/h6-9H,4-5H2,1-3H3
InChIKeyDNCINNPMRFYYDC-UHFFFAOYSA-N
MW283.34 g/mol
LogP2.21
Rot. Bonds3

About N-ethyl-N-(1-ethyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)acetamide

N-ethyl-N-(1-ethyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)acetamide (PubChem CID 13385732) has the molecular formula C15H17N5O and a molecular weight of 283.34 g/mol. Its IUPAC name is N-ethyl-N-(1-ethyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)acetamide.

Molecular Properties

Compound NameN-ethyl-N-(1-ethyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)acetamide
PubChem CID13385732
Molecular FormulaC15H17N5O
Molecular Weight283.34 g/mol
Exact Mass283.14
IUPAC NameN-ethyl-N-(1-ethyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)acetamide
SMILESCCc1nnc2c(N(CC)C(C)=O)nc3ccccc3n12
InChIInChI=1S/C15H17N5O/c1-4-13-17-18-15-14(19(5-2)10(3)21)16-11-8-6-7-9-12(11)20(13)15/h6-9H,4-5H2,1-3H3
InChIKeyDNCINNPMRFYYDC-UHFFFAOYSA-N
XLogP2.21
TPSA63.39 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.34
LogP ≤ 52.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(1-ethyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)acetamide?
The IUPAC name of N-ethyl-N-(1-ethyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)acetamide (CID 13385732) is N-ethyl-N-(1-ethyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)acetamide.
What is the SMILES notation for N-ethyl-N-(1-ethyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)acetamide?
The canonical SMILES for N-ethyl-N-(1-ethyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)acetamide is CCc1nnc2c(N(CC)C(C)=O)nc3ccccc3n12.
What is the InChIKey of N-ethyl-N-(1-ethyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)acetamide?
The InChIKey is DNCINNPMRFYYDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N5O/c1-4-13-17-18-15-14(19(5-2)10(3)21)16-11-8-6-7-9-12(11)20(13)15/h6-9H,4-5H2,1-3H3.
What are the key properties of N-ethyl-N-(1-ethyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)acetamide?
N-ethyl-N-(1-ethyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)acetamide has a molecular weight of 283.34 g/mol, XLogP of 2.21, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(1-ethyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)acetamide is sourced from PubChem (CID 13385732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).