(5-amino-6-methoxypyrazin-2-yl)-(4-methylpiperazin-1-yl)methanone

C11H17N5O2 — CID 139192807

IUPAC(5-amino-6-methoxypyrazin-2-yl)-(4-methylpiperazin-1-yl)methanone
SMILESCOc1nc(C(=O)N2CCN(C)CC2)cnc1N
InChIInChI=1S/C11H17N5O2/c1-15-3-5-16(6-4-15)11(17)8-7-13-9(12)10(14-8)18-2/h7H,3-6H2,1-2H3,(H2,12,13)
InChIKeyRAYNEZDLOVCLCO-UHFFFAOYSA-N
MW251.29 g/mol
LogP-0.55
Rot. Bonds2

About (5-amino-6-methoxypyrazin-2-yl)-(4-methylpiperazin-1-yl)methanone

(5-amino-6-methoxypyrazin-2-yl)-(4-methylpiperazin-1-yl)methanone (PubChem CID 139192807) has the molecular formula C11H17N5O2 and a molecular weight of 251.29 g/mol. Its IUPAC name is (5-amino-6-methoxypyrazin-2-yl)-(4-methylpiperazin-1-yl)methanone.

Molecular Properties

Compound Name(5-amino-6-methoxypyrazin-2-yl)-(4-methylpiperazin-1-yl)methanone
PubChem CID139192807
Molecular FormulaC11H17N5O2
Molecular Weight251.29 g/mol
Exact Mass251.14
IUPAC Name(5-amino-6-methoxypyrazin-2-yl)-(4-methylpiperazin-1-yl)methanone
SMILESCOc1nc(C(=O)N2CCN(C)CC2)cnc1N
InChIInChI=1S/C11H17N5O2/c1-15-3-5-16(6-4-15)11(17)8-7-13-9(12)10(14-8)18-2/h7H,3-6H2,1-2H3,(H2,12,13)
InChIKeyRAYNEZDLOVCLCO-UHFFFAOYSA-N
XLogP-0.55
TPSA84.58 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.29
LogP ≤ 5-0.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

Lcb-2183
CID 135418284
7-Methoxy-1,3-dimethylpteridine-2,4-dione
CID 822210
6-(2,6-Dimethylmorpholin-4-yl)pyrazine-2-carboxamide
CID 479364
Pteridine, 2-amino-4-hydroxy-6-methoxy-
CID 136302252
3-Methoxy-N-[1-(pyrazine-2-carbonyl)piperidin-4-YL]pyrazin-2-amine
CID 53185540
N-[1-(3-methoxypyrazin-2-yl)pyrrolidin-3-yl]pyrazine-2-carboxamide
CID 53185604
N-[1-(3-ethoxy-2-pyrazinyl)tetrahydro-1H-pyrrol-3-yl]-2-pyrazinecarboxamide
CID 53185653
N-Methyl-N-[1-(3-propoxypyrazin-2-YL)pyrrolidin-3-YL]pyrazine-2-carboxamide
CID 53185690
N-[1-(3-Ethoxypyrazin-2-YL)pyrrolidin-3-YL]-N-methylpyrazine-2-carboxamide
CID 53185700
N-[1-(3-methoxy-2-pyrazinyl)tetrahydro-1H-pyrrol-3-yl]-N-methyl-2-pyrazinecarboxamide
CID 53185722
Pteridine, 2-amino-3,4-dihydro-6-methoxy-3-methyl-4-oxo-
CID 130017594
Pteridine, 2-amino-6-ethoxy-4-hydroxy-
CID 137181704

Frequently Asked Questions

What is the IUPAC name of (5-amino-6-methoxypyrazin-2-yl)-(4-methylpiperazin-1-yl)methanone?
The IUPAC name of (5-amino-6-methoxypyrazin-2-yl)-(4-methylpiperazin-1-yl)methanone (CID 139192807) is (5-amino-6-methoxypyrazin-2-yl)-(4-methylpiperazin-1-yl)methanone.
What is the SMILES notation for (5-amino-6-methoxypyrazin-2-yl)-(4-methylpiperazin-1-yl)methanone?
The canonical SMILES for (5-amino-6-methoxypyrazin-2-yl)-(4-methylpiperazin-1-yl)methanone is COc1nc(C(=O)N2CCN(C)CC2)cnc1N.
What is the InChIKey of (5-amino-6-methoxypyrazin-2-yl)-(4-methylpiperazin-1-yl)methanone?
The InChIKey is RAYNEZDLOVCLCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N5O2/c1-15-3-5-16(6-4-15)11(17)8-7-13-9(12)10(14-8)18-2/h7H,3-6H2,1-2H3,(H2,12,13).
What are the key properties of (5-amino-6-methoxypyrazin-2-yl)-(4-methylpiperazin-1-yl)methanone?
(5-amino-6-methoxypyrazin-2-yl)-(4-methylpiperazin-1-yl)methanone has a molecular weight of 251.29 g/mol, XLogP of -0.55, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (5-amino-6-methoxypyrazin-2-yl)-(4-methylpiperazin-1-yl)methanone is sourced from PubChem (CID 139192807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).