N,4-dimethyl-1-[2-(9-oxo-3,4,6,7,8,9a-hexahydro-1H-pyrazino[1,2-a]pyrazin-2-yl)ethyl]piperazine-2-carboxamide

C16H30N6O2 — CID 123919789

IUPACN,4-dimethyl-1-[2-(9-oxo-3,4,6,7,8,9a-hexahydro-1H-pyrazino[1,2-a]pyrazin-2-yl)ethyl]piperazine-2-carboxamide
SMILESCNC(=O)C1CN(C)CCN1CCN1CCN2CCNC(=O)C2C1
InChIInChI=1S/C16H30N6O2/c1-17-15(23)13-11-19(2)5-8-22(13)10-7-20-6-9-21-4-3-18-16(24)14(21)12-20/h13-14H,3-12H2,1-2H3,(H,17,23)(H,18,24)
InChIKeyGKRGVGIGFYMIOF-UHFFFAOYSA-N
MW338.46 g/mol
LogP-2.54
Rot. Bonds4

About N,4-dimethyl-1-[2-(9-oxo-3,4,6,7,8,9a-hexahydro-1H-pyrazino[1,2-a]pyrazin-2-yl)ethyl]piperazine-2-carboxamide

N,4-dimethyl-1-[2-(9-oxo-3,4,6,7,8,9a-hexahydro-1H-pyrazino[1,2-a]pyrazin-2-yl)ethyl]piperazine-2-carboxamide (PubChem CID 123919789) has the molecular formula C16H30N6O2 and a molecular weight of 338.46 g/mol. Its IUPAC name is N,4-dimethyl-1-[2-(9-oxo-3,4,6,7,8,9a-hexahydro-1H-pyrazino[1,2-a]pyrazin-2-yl)ethyl]piperazine-2-carboxamide.

Molecular Properties

Compound NameN,4-dimethyl-1-[2-(9-oxo-3,4,6,7,8,9a-hexahydro-1H-pyrazino[1,2-a]pyrazin-2-yl)ethyl]piperazine-2-carboxamide
PubChem CID123919789
Molecular FormulaC16H30N6O2
Molecular Weight338.46 g/mol
Exact Mass338.24
IUPAC NameN,4-dimethyl-1-[2-(9-oxo-3,4,6,7,8,9a-hexahydro-1H-pyrazino[1,2-a]pyrazin-2-yl)ethyl]piperazine-2-carboxamide
SMILESCNC(=O)C1CN(C)CCN1CCN1CCN2CCNC(=O)C2C1
InChIInChI=1S/C16H30N6O2/c1-17-15(23)13-11-19(2)5-8-22(13)10-7-20-6-9-21-4-3-18-16(24)14(21)12-20/h13-14H,3-12H2,1-2H3,(H,17,23)(H,18,24)
InChIKeyGKRGVGIGFYMIOF-UHFFFAOYSA-N
XLogP-2.54
TPSA71.16 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.46
LogP ≤ 5-2.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N,4-dimethyl-1-[2-(9-oxo-3,4,6,7,8,9a-hexahydro-1H-pyrazino[1,2-a]pyrazin-2-yl)ethyl]piperazine-2-carboxamide with MolForge

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Related Compounds

(3S,10R)-1,5,8,12-tetrazatricyclo[8.4.0.03,8]tetradecane-4,6,11,13-tetrone
CID 13526552
2-methylhexahydro-2H-pyrazino[1,2-a]pyrazin-1(6H)-one
CID 51072205
Tetrahydro-2H-pyrazino[1,2-a]pyrazine-1,4(3H,6H)-dione
CID 51072206
2-methyltetrahydro-2H-pyrazino[1,2-a]pyrazine-1,4(3H,6H)-dione
CID 51072207
(3R,10R)-1,5,8,12-tetrazatricyclo[8.4.0.03,8]tetradecane-4,6,11,13-tetrone
CID 13526553
3,6-Bis(piperidin-1-ylmethyl)piperazine-2,5-dione
CID 320052
hexahydro-2H-pyrazino[1,2-a]pyrazin-1(6H)-one
CID 45122044
2-(3-Amino-5-fluoropiperidin-4-yl)-8-methyl-1,3,4,6,7,9a-hexahydropyrazino[1,2-a]pyrazin-9-one
CID 123645954
Tetrahydro-2h-pyrazino[1,2-a]pyrazine-3,6,9(4h)-trione
CID 169488835
2-[4-[2-oxo-2-(propan-2-ylamino)ethyl]-1,4-diazoniabicyclo[2.2.2]octan-1-yl]-N-propan-2-ylacetamide
CID 2394974
(3S,9aR)-3-methyl-3,6,7,8,9,9a-hexahydro-2H-pyrazino[1,2-a]pyrazine-1,4-dione
CID 7161709
8-{[cyclopentyl(methyl)amino]acetyl}tetrahydro-2H-pyrazino[1,2-a]pyrazine-1,4(3H,6H)-dione
CID 50954739

Frequently Asked Questions

What is the IUPAC name of N,4-dimethyl-1-[2-(9-oxo-3,4,6,7,8,9a-hexahydro-1H-pyrazino[1,2-a]pyrazin-2-yl)ethyl]piperazine-2-carboxamide?
The IUPAC name of N,4-dimethyl-1-[2-(9-oxo-3,4,6,7,8,9a-hexahydro-1H-pyrazino[1,2-a]pyrazin-2-yl)ethyl]piperazine-2-carboxamide (CID 123919789) is N,4-dimethyl-1-[2-(9-oxo-3,4,6,7,8,9a-hexahydro-1H-pyrazino[1,2-a]pyrazin-2-yl)ethyl]piperazine-2-carboxamide.
What is the SMILES notation for N,4-dimethyl-1-[2-(9-oxo-3,4,6,7,8,9a-hexahydro-1H-pyrazino[1,2-a]pyrazin-2-yl)ethyl]piperazine-2-carboxamide?
The canonical SMILES for N,4-dimethyl-1-[2-(9-oxo-3,4,6,7,8,9a-hexahydro-1H-pyrazino[1,2-a]pyrazin-2-yl)ethyl]piperazine-2-carboxamide is CNC(=O)C1CN(C)CCN1CCN1CCN2CCNC(=O)C2C1.
What is the InChIKey of N,4-dimethyl-1-[2-(9-oxo-3,4,6,7,8,9a-hexahydro-1H-pyrazino[1,2-a]pyrazin-2-yl)ethyl]piperazine-2-carboxamide?
The InChIKey is GKRGVGIGFYMIOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N6O2/c1-17-15(23)13-11-19(2)5-8-22(13)10-7-20-6-9-21-4-3-18-16(24)14(21)12-20/h13-14H,3-12H2,1-2H3,(H,17,23)(H,18,24).
What are the key properties of N,4-dimethyl-1-[2-(9-oxo-3,4,6,7,8,9a-hexahydro-1H-pyrazino[1,2-a]pyrazin-2-yl)ethyl]piperazine-2-carboxamide?
N,4-dimethyl-1-[2-(9-oxo-3,4,6,7,8,9a-hexahydro-1H-pyrazino[1,2-a]pyrazin-2-yl)ethyl]piperazine-2-carboxamide has a molecular weight of 338.46 g/mol, XLogP of -2.54, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-dimethyl-1-[2-(9-oxo-3,4,6,7,8,9a-hexahydro-1H-pyrazino[1,2-a]pyrazin-2-yl)ethyl]piperazine-2-carboxamide is sourced from PubChem (CID 123919789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).