7-methoxy-N,N-dimethyl-4-oxo-1-piperidin-1-yl-5H-imidazo[1,5-a]quinoxaline-8-carboxamide

C19H23N5O3 — CID 59198715

IUPAC7-methoxy-N,N-dimethyl-4-oxo-1-piperidin-1-yl-5H-imidazo[1,5-a]quinoxaline-8-carboxamide
SMILESCOc1cc2[nH]c(=O)c3cnc(N4CCCCC4)n3c2cc1C(=O)N(C)C
InChIInChI=1S/C19H23N5O3/c1-22(2)18(26)12-9-14-13(10-16(12)27-3)21-17(25)15-11-20-19(24(14)15)23-7-5-4-6-8-23/h9-11H,4-8H2,1-3H3,(H,21,25)
InChIKeyWCDLPFNDEAHBJB-UHFFFAOYSA-N
MW369.43 g/mol
LogP1.88
Rot. Bonds3

About 7-methoxy-N,N-dimethyl-4-oxo-1-piperidin-1-yl-5H-imidazo[1,5-a]quinoxaline-8-carboxamide

7-methoxy-N,N-dimethyl-4-oxo-1-piperidin-1-yl-5H-imidazo[1,5-a]quinoxaline-8-carboxamide (PubChem CID 59198715) has the molecular formula C19H23N5O3 and a molecular weight of 369.43 g/mol. Its IUPAC name is 7-methoxy-N,N-dimethyl-4-oxo-1-piperidin-1-yl-5H-imidazo[1,5-a]quinoxaline-8-carboxamide.

Molecular Properties

Compound Name7-methoxy-N,N-dimethyl-4-oxo-1-piperidin-1-yl-5H-imidazo[1,5-a]quinoxaline-8-carboxamide
PubChem CID59198715
Molecular FormulaC19H23N5O3
Molecular Weight369.43 g/mol
Exact Mass369.18
IUPAC Name7-methoxy-N,N-dimethyl-4-oxo-1-piperidin-1-yl-5H-imidazo[1,5-a]quinoxaline-8-carboxamide
SMILESCOc1cc2[nH]c(=O)c3cnc(N4CCCCC4)n3c2cc1C(=O)N(C)C
InChIInChI=1S/C19H23N5O3/c1-22(2)18(26)12-9-14-13(10-16(12)27-3)21-17(25)15-11-20-19(24(14)15)23-7-5-4-6-8-23/h9-11H,4-8H2,1-3H3,(H,21,25)
InChIKeyWCDLPFNDEAHBJB-UHFFFAOYSA-N
XLogP1.88
TPSA82.94 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.43
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 7-methoxy-N,N-dimethyl-4-oxo-1-piperidin-1-yl-5H-imidazo[1,5-a]quinoxaline-8-carboxamide?
The IUPAC name of 7-methoxy-N,N-dimethyl-4-oxo-1-piperidin-1-yl-5H-imidazo[1,5-a]quinoxaline-8-carboxamide (CID 59198715) is 7-methoxy-N,N-dimethyl-4-oxo-1-piperidin-1-yl-5H-imidazo[1,5-a]quinoxaline-8-carboxamide.
What is the SMILES notation for 7-methoxy-N,N-dimethyl-4-oxo-1-piperidin-1-yl-5H-imidazo[1,5-a]quinoxaline-8-carboxamide?
The canonical SMILES for 7-methoxy-N,N-dimethyl-4-oxo-1-piperidin-1-yl-5H-imidazo[1,5-a]quinoxaline-8-carboxamide is COc1cc2[nH]c(=O)c3cnc(N4CCCCC4)n3c2cc1C(=O)N(C)C.
What is the InChIKey of 7-methoxy-N,N-dimethyl-4-oxo-1-piperidin-1-yl-5H-imidazo[1,5-a]quinoxaline-8-carboxamide?
The InChIKey is WCDLPFNDEAHBJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N5O3/c1-22(2)18(26)12-9-14-13(10-16(12)27-3)21-17(25)15-11-20-19(24(14)15)23-7-5-4-6-8-23/h9-11H,4-8H2,1-3H3,(H,21,25).
What are the key properties of 7-methoxy-N,N-dimethyl-4-oxo-1-piperidin-1-yl-5H-imidazo[1,5-a]quinoxaline-8-carboxamide?
7-methoxy-N,N-dimethyl-4-oxo-1-piperidin-1-yl-5H-imidazo[1,5-a]quinoxaline-8-carboxamide has a molecular weight of 369.43 g/mol, XLogP of 1.88, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-N,N-dimethyl-4-oxo-1-piperidin-1-yl-5H-imidazo[1,5-a]quinoxaline-8-carboxamide is sourced from PubChem (CID 59198715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).