N-[2-(7-methoxy-1,8-dioxo-3,4-dihydropyrido[1,2-a]pyrazin-2-yl)ethyl]-2-oxo-1H-pyridine-3-carboxamide

C17H18N4O5 — CID 27378055

IUPACN-[2-(7-methoxy-1,8-dioxo-3,4-dihydropyrido[1,2-a]pyrazin-2-yl)ethyl]-2-oxo-1H-pyridine-3-carboxamide
SMILESCOc1cn2c(cc1=O)C(=O)N(CCNC(=O)c1ccc[nH]c1=O)CC2
InChIInChI=1S/C17H18N4O5/c1-26-14-10-21-8-7-20(17(25)12(21)9-13(14)22)6-5-19-16(24)11-3-2-4-18-15(11)23/h2-4,9-10H,5-8H2,1H3,(H,18,23)(H,19,24)
InChIKeyQAIKCWTVOKWEKB-UHFFFAOYSA-N
MW358.35 g/mol
LogP-0.57
Rot. Bonds5

About N-[2-(7-methoxy-1,8-dioxo-3,4-dihydropyrido[1,2-a]pyrazin-2-yl)ethyl]-2-oxo-1H-pyridine-3-carboxamide

N-[2-(7-methoxy-1,8-dioxo-3,4-dihydropyrido[1,2-a]pyrazin-2-yl)ethyl]-2-oxo-1H-pyridine-3-carboxamide (PubChem CID 27378055) has the molecular formula C17H18N4O5 and a molecular weight of 358.35 g/mol. Its IUPAC name is N-[2-(7-methoxy-1,8-dioxo-3,4-dihydropyrido[1,2-a]pyrazin-2-yl)ethyl]-2-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[2-(7-methoxy-1,8-dioxo-3,4-dihydropyrido[1,2-a]pyrazin-2-yl)ethyl]-2-oxo-1H-pyridine-3-carboxamide
PubChem CID27378055
Molecular FormulaC17H18N4O5
Molecular Weight358.35 g/mol
Exact Mass358.13
IUPAC NameN-[2-(7-methoxy-1,8-dioxo-3,4-dihydropyrido[1,2-a]pyrazin-2-yl)ethyl]-2-oxo-1H-pyridine-3-carboxamide
SMILESCOc1cn2c(cc1=O)C(=O)N(CCNC(=O)c1ccc[nH]c1=O)CC2
InChIInChI=1S/C17H18N4O5/c1-26-14-10-21-8-7-20(17(25)12(21)9-13(14)22)6-5-19-16(24)11-3-2-4-18-15(11)23/h2-4,9-10H,5-8H2,1H3,(H,18,23)(H,19,24)
InChIKeyQAIKCWTVOKWEKB-UHFFFAOYSA-N
XLogP-0.57
TPSA113.50 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.35
LogP ≤ 5-0.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[2-(7-methoxy-1,8-dioxo-3,4-dihydropyrido[1,2-a]pyrazin-2-yl)ethyl]-2-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-[2-(7-methoxy-1,8-dioxo-3,4-dihydropyrido[1,2-a]pyrazin-2-yl)ethyl]-2-oxo-1H-pyridine-3-carboxamide (CID 27378055) is N-[2-(7-methoxy-1,8-dioxo-3,4-dihydropyrido[1,2-a]pyrazin-2-yl)ethyl]-2-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-[2-(7-methoxy-1,8-dioxo-3,4-dihydropyrido[1,2-a]pyrazin-2-yl)ethyl]-2-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-[2-(7-methoxy-1,8-dioxo-3,4-dihydropyrido[1,2-a]pyrazin-2-yl)ethyl]-2-oxo-1H-pyridine-3-carboxamide is COc1cn2c(cc1=O)C(=O)N(CCNC(=O)c1ccc[nH]c1=O)CC2.
What is the InChIKey of N-[2-(7-methoxy-1,8-dioxo-3,4-dihydropyrido[1,2-a]pyrazin-2-yl)ethyl]-2-oxo-1H-pyridine-3-carboxamide?
The InChIKey is QAIKCWTVOKWEKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N4O5/c1-26-14-10-21-8-7-20(17(25)12(21)9-13(14)22)6-5-19-16(24)11-3-2-4-18-15(11)23/h2-4,9-10H,5-8H2,1H3,(H,18,23)(H,19,24).
What are the key properties of N-[2-(7-methoxy-1,8-dioxo-3,4-dihydropyrido[1,2-a]pyrazin-2-yl)ethyl]-2-oxo-1H-pyridine-3-carboxamide?
N-[2-(7-methoxy-1,8-dioxo-3,4-dihydropyrido[1,2-a]pyrazin-2-yl)ethyl]-2-oxo-1H-pyridine-3-carboxamide has a molecular weight of 358.35 g/mol, XLogP of -0.57, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(7-methoxy-1,8-dioxo-3,4-dihydropyrido[1,2-a]pyrazin-2-yl)ethyl]-2-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 27378055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).