N,5-bis(2-methylpropyl)-4-oxopyrazolo[1,5-a]quinoxaline-2-carboxamide

C19H24N4O2 — CID 53194389

IUPACN,5-bis(2-methylpropyl)-4-oxopyrazolo[1,5-a]quinoxaline-2-carboxamide
SMILESCC(C)CNC(=O)c1cc2c(=O)n(CC(C)C)c3ccccc3n2n1
InChIInChI=1S/C19H24N4O2/c1-12(2)10-20-18(24)14-9-17-19(25)22(11-13(3)4)15-7-5-6-8-16(15)23(17)21-14/h5-9,12-13H,10-11H2,1-4H3,(H,20,24)
InChIKeyMGQHCCRKPJISAI-UHFFFAOYSA-N
MW340.43 g/mol
LogP2.69
Rot. Bonds5

About N,5-bis(2-methylpropyl)-4-oxopyrazolo[1,5-a]quinoxaline-2-carboxamide

N,5-bis(2-methylpropyl)-4-oxopyrazolo[1,5-a]quinoxaline-2-carboxamide (PubChem CID 53194389) has the molecular formula C19H24N4O2 and a molecular weight of 340.43 g/mol. Its IUPAC name is N,5-bis(2-methylpropyl)-4-oxopyrazolo[1,5-a]quinoxaline-2-carboxamide.

Molecular Properties

Compound NameN,5-bis(2-methylpropyl)-4-oxopyrazolo[1,5-a]quinoxaline-2-carboxamide
PubChem CID53194389
Molecular FormulaC19H24N4O2
Molecular Weight340.43 g/mol
Exact Mass340.19
IUPAC NameN,5-bis(2-methylpropyl)-4-oxopyrazolo[1,5-a]quinoxaline-2-carboxamide
SMILESCC(C)CNC(=O)c1cc2c(=O)n(CC(C)C)c3ccccc3n2n1
InChIInChI=1S/C19H24N4O2/c1-12(2)10-20-18(24)14-9-17-19(25)22(11-13(3)4)15-7-5-6-8-16(15)23(17)21-14/h5-9,12-13H,10-11H2,1-4H3,(H,20,24)
InChIKeyMGQHCCRKPJISAI-UHFFFAOYSA-N
XLogP2.69
TPSA68.40 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,5-bis(2-methylpropyl)-4-oxopyrazolo[1,5-a]quinoxaline-2-carboxamide?
The IUPAC name of N,5-bis(2-methylpropyl)-4-oxopyrazolo[1,5-a]quinoxaline-2-carboxamide (CID 53194389) is N,5-bis(2-methylpropyl)-4-oxopyrazolo[1,5-a]quinoxaline-2-carboxamide.
What is the SMILES notation for N,5-bis(2-methylpropyl)-4-oxopyrazolo[1,5-a]quinoxaline-2-carboxamide?
The canonical SMILES for N,5-bis(2-methylpropyl)-4-oxopyrazolo[1,5-a]quinoxaline-2-carboxamide is CC(C)CNC(=O)c1cc2c(=O)n(CC(C)C)c3ccccc3n2n1.
What is the InChIKey of N,5-bis(2-methylpropyl)-4-oxopyrazolo[1,5-a]quinoxaline-2-carboxamide?
The InChIKey is MGQHCCRKPJISAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O2/c1-12(2)10-20-18(24)14-9-17-19(25)22(11-13(3)4)15-7-5-6-8-16(15)23(17)21-14/h5-9,12-13H,10-11H2,1-4H3,(H,20,24).
What are the key properties of N,5-bis(2-methylpropyl)-4-oxopyrazolo[1,5-a]quinoxaline-2-carboxamide?
N,5-bis(2-methylpropyl)-4-oxopyrazolo[1,5-a]quinoxaline-2-carboxamide has a molecular weight of 340.43 g/mol, XLogP of 2.69, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,5-bis(2-methylpropyl)-4-oxopyrazolo[1,5-a]quinoxaline-2-carboxamide is sourced from PubChem (CID 53194389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).