N-[2-[4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]-6-oxo-1H-pyrazine-3-carboxamide

C16H20N6O4 — CID 56901569

IUPACN-[2-[4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]-6-oxo-1H-pyrazine-3-carboxamide
SMILESCn1ncc(N2CCOC(CCNC(=O)c3c[nH]c(=O)cn3)C2)cc1=O
InChIInChI=1S/C16H20N6O4/c1-21-15(24)6-11(7-20-21)22-4-5-26-12(10-22)2-3-17-16(25)13-8-19-14(23)9-18-13/h6-9,12H,2-5,10H2,1H3,(H,17,25)(H,19,23)
InChIKeyQIOZZCZVDREMQH-UHFFFAOYSA-N
MW360.37 g/mol
LogP-1.11
Rot. Bonds5

About N-[2-[4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]-6-oxo-1H-pyrazine-3-carboxamide

N-[2-[4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]-6-oxo-1H-pyrazine-3-carboxamide (PubChem CID 56901569) has the molecular formula C16H20N6O4 and a molecular weight of 360.37 g/mol. Its IUPAC name is N-[2-[4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]-6-oxo-1H-pyrazine-3-carboxamide.

Molecular Properties

Compound NameN-[2-[4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]-6-oxo-1H-pyrazine-3-carboxamide
PubChem CID56901569
Molecular FormulaC16H20N6O4
Molecular Weight360.37 g/mol
Exact Mass360.15
IUPAC NameN-[2-[4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]-6-oxo-1H-pyrazine-3-carboxamide
SMILESCn1ncc(N2CCOC(CCNC(=O)c3c[nH]c(=O)cn3)C2)cc1=O
InChIInChI=1S/C16H20N6O4/c1-21-15(24)6-11(7-20-21)22-4-5-26-12(10-22)2-3-17-16(25)13-8-19-14(23)9-18-13/h6-9,12H,2-5,10H2,1H3,(H,17,25)(H,19,23)
InChIKeyQIOZZCZVDREMQH-UHFFFAOYSA-N
XLogP-1.11
TPSA122.21 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.37
LogP ≤ 5-1.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of N-[2-[4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]-6-oxo-1H-pyrazine-3-carboxamide?
The IUPAC name of N-[2-[4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]-6-oxo-1H-pyrazine-3-carboxamide (CID 56901569) is N-[2-[4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]-6-oxo-1H-pyrazine-3-carboxamide.
What is the SMILES notation for N-[2-[4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]-6-oxo-1H-pyrazine-3-carboxamide?
The canonical SMILES for N-[2-[4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]-6-oxo-1H-pyrazine-3-carboxamide is Cn1ncc(N2CCOC(CCNC(=O)c3c[nH]c(=O)cn3)C2)cc1=O.
What is the InChIKey of N-[2-[4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]-6-oxo-1H-pyrazine-3-carboxamide?
The InChIKey is QIOZZCZVDREMQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N6O4/c1-21-15(24)6-11(7-20-21)22-4-5-26-12(10-22)2-3-17-16(25)13-8-19-14(23)9-18-13/h6-9,12H,2-5,10H2,1H3,(H,17,25)(H,19,23).
What are the key properties of N-[2-[4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]-6-oxo-1H-pyrazine-3-carboxamide?
N-[2-[4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]-6-oxo-1H-pyrazine-3-carboxamide has a molecular weight of 360.37 g/mol, XLogP of -1.11, 5 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]-6-oxo-1H-pyrazine-3-carboxamide is sourced from PubChem (CID 56901569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).