N,N-dimethyl-4-oxo-1-propan-2-yl-5H-imidazo[1,5-a]quinoxaline-7-carboxamide

C16H18N4O2 — CID 24822200

IUPACN,N-dimethyl-4-oxo-1-propan-2-yl-5H-imidazo[1,5-a]quinoxaline-7-carboxamide
SMILESCC(C)c1ncc2c(=O)[nH]c3cc(C(=O)N(C)C)ccc3n12
InChIInChI=1S/C16H18N4O2/c1-9(2)14-17-8-13-15(21)18-11-7-10(16(22)19(3)4)5-6-12(11)20(13)14/h5-9H,1-4H3,(H,18,21)
InChIKeyAMPVKPFOYDLLCK-UHFFFAOYSA-N
MW298.35 g/mol
LogP2.00
Rot. Bonds2

About N,N-dimethyl-4-oxo-1-propan-2-yl-5H-imidazo[1,5-a]quinoxaline-7-carboxamide

N,N-dimethyl-4-oxo-1-propan-2-yl-5H-imidazo[1,5-a]quinoxaline-7-carboxamide (PubChem CID 24822200) has the molecular formula C16H18N4O2 and a molecular weight of 298.35 g/mol. Its IUPAC name is N,N-dimethyl-4-oxo-1-propan-2-yl-5H-imidazo[1,5-a]quinoxaline-7-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-4-oxo-1-propan-2-yl-5H-imidazo[1,5-a]quinoxaline-7-carboxamide
PubChem CID24822200
Molecular FormulaC16H18N4O2
Molecular Weight298.35 g/mol
Exact Mass298.14
IUPAC NameN,N-dimethyl-4-oxo-1-propan-2-yl-5H-imidazo[1,5-a]quinoxaline-7-carboxamide
SMILESCC(C)c1ncc2c(=O)[nH]c3cc(C(=O)N(C)C)ccc3n12
InChIInChI=1S/C16H18N4O2/c1-9(2)14-17-8-13-15(21)18-11-7-10(16(22)19(3)4)5-6-12(11)20(13)14/h5-9H,1-4H3,(H,18,21)
InChIKeyAMPVKPFOYDLLCK-UHFFFAOYSA-N
XLogP2.00
TPSA70.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.35
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-oxo-1-propan-2-yl-5H-imidazo[1,5-a]quinoxaline-7-carboxamide?
The IUPAC name of N,N-dimethyl-4-oxo-1-propan-2-yl-5H-imidazo[1,5-a]quinoxaline-7-carboxamide (CID 24822200) is N,N-dimethyl-4-oxo-1-propan-2-yl-5H-imidazo[1,5-a]quinoxaline-7-carboxamide.
What is the SMILES notation for N,N-dimethyl-4-oxo-1-propan-2-yl-5H-imidazo[1,5-a]quinoxaline-7-carboxamide?
The canonical SMILES for N,N-dimethyl-4-oxo-1-propan-2-yl-5H-imidazo[1,5-a]quinoxaline-7-carboxamide is CC(C)c1ncc2c(=O)[nH]c3cc(C(=O)N(C)C)ccc3n12.
What is the InChIKey of N,N-dimethyl-4-oxo-1-propan-2-yl-5H-imidazo[1,5-a]quinoxaline-7-carboxamide?
The InChIKey is AMPVKPFOYDLLCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4O2/c1-9(2)14-17-8-13-15(21)18-11-7-10(16(22)19(3)4)5-6-12(11)20(13)14/h5-9H,1-4H3,(H,18,21).
What are the key properties of N,N-dimethyl-4-oxo-1-propan-2-yl-5H-imidazo[1,5-a]quinoxaline-7-carboxamide?
N,N-dimethyl-4-oxo-1-propan-2-yl-5H-imidazo[1,5-a]quinoxaline-7-carboxamide has a molecular weight of 298.35 g/mol, XLogP of 2.00, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-oxo-1-propan-2-yl-5H-imidazo[1,5-a]quinoxaline-7-carboxamide is sourced from PubChem (CID 24822200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).