(2R,6S)-2-methyl-6-[(4-methylpiperazin-1-yl)methyl]-4-pyrido[2,3-b]pyrazin-8-ylmorpholine

C18H26N6O — CID 129240999

IUPAC(2R,6S)-2-methyl-6-[(4-methylpiperazin-1-yl)methyl]-4-pyrido[2,3-b]pyrazin-8-ylmorpholine
SMILESC[C@@H]1CN(c2ccnc3nccnc23)C[C@H](CN2CCN(C)CC2)O1
InChIInChI=1S/C18H26N6O/c1-14-11-24(16-3-4-20-18-17(16)19-5-6-21-18)13-15(25-14)12-23-9-7-22(2)8-10-23/h3-6,14-15H,7-13H2,1-2H3/t14-,15+/m1/s1
InChIKeyGAQQPHSKJXIYEN-CABCVRRESA-N
MW342.45 g/mol
LogP0.87
Rot. Bonds3

About (2R,6S)-2-methyl-6-[(4-methylpiperazin-1-yl)methyl]-4-pyrido[2,3-b]pyrazin-8-ylmorpholine

(2R,6S)-2-methyl-6-[(4-methylpiperazin-1-yl)methyl]-4-pyrido[2,3-b]pyrazin-8-ylmorpholine (PubChem CID 129240999) has the molecular formula C18H26N6O and a molecular weight of 342.45 g/mol. Its IUPAC name is (2R,6S)-2-methyl-6-[(4-methylpiperazin-1-yl)methyl]-4-pyrido[2,3-b]pyrazin-8-ylmorpholine.

Molecular Properties

Compound Name(2R,6S)-2-methyl-6-[(4-methylpiperazin-1-yl)methyl]-4-pyrido[2,3-b]pyrazin-8-ylmorpholine
PubChem CID129240999
Molecular FormulaC18H26N6O
Molecular Weight342.45 g/mol
Exact Mass342.22
IUPAC Name(2R,6S)-2-methyl-6-[(4-methylpiperazin-1-yl)methyl]-4-pyrido[2,3-b]pyrazin-8-ylmorpholine
SMILESC[C@@H]1CN(c2ccnc3nccnc23)C[C@H](CN2CCN(C)CC2)O1
InChIInChI=1S/C18H26N6O/c1-14-11-24(16-3-4-20-18-17(16)19-5-6-21-18)13-15(25-14)12-23-9-7-22(2)8-10-23/h3-6,14-15H,7-13H2,1-2H3/t14-,15+/m1/s1
InChIKeyGAQQPHSKJXIYEN-CABCVRRESA-N
XLogP0.87
TPSA57.62 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.45
LogP ≤ 50.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze (2R,6S)-2-methyl-6-[(4-methylpiperazin-1-yl)methyl]-4-pyrido[2,3-b]pyrazin-8-ylmorpholine with MolForge

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Related Compounds

N-ethyl-1-[(6-methyl-4-pyrido[2,3-b]pyrazin-8-ylmorpholin-2-yl)methyl]piperidine-4-carboxamide
CID 129280526
5-[(2R,6R)-2-methyl-6-[(4-methylpiperazin-1-yl)methyl]morpholin-4-yl]quinoline-8-carbonitrile
CID 118007152
(2R,6S)-2-methyl-4-(8-methylquinoxalin-5-yl)-6-[[4-(2-piperazin-1-ylpyrimidin-4-yl)piperazin-1-yl]methyl]morpholine
CID 156702760
8-[(2S)-2-[(4-hydroxypiperidin-1-yl)methyl]-6-methylmorpholin-4-yl]quinoxaline-5-carbonitrile
CID 146329690
5-[(2R,6S)-2-methyl-6-[[4-(1-methylpiperidin-4-yl)piperidin-1-yl]methyl]morpholin-4-yl]quinoline-8-carbonitrile
CID 118007022
8-[(2S,6R)-2-[[4-(diethylamino)piperidin-1-yl]methyl]-6-methylmorpholin-4-yl]quinoxaline-5-carbonitrile
CID 146329141
tert-butyl 4-[[(2S,6R)-6-methyl-4-pyrido[2,3-b]pyrazin-8-ylmorpholin-2-yl]methyl]piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;(2R,6S)-2-methyl-6-(piperidin-1-ylmethyl)-4-pyrido[2,3-b]pyrazin-8-ylmorpholine;[(2R,6R)-6-methyl-4-pyrido[2,3-b]pyrazin-8-ylmorpholin-2-yl]methyl 4-methylbenzenesulfonate;hydrochloride
CID 159650365
5-[(2S,6R)-2-[(4-ethylpiperazin-1-yl)methyl]-6-methylmorpholin-4-yl]quinoline-8-carbonitrile
CID 118006976
8-[2-methyl-6-[[4-[(6S)-6-methyl-5,6,7,8-tetrahydro-2,7-naphthyridin-3-yl]piperazin-1-yl]methyl]morpholin-4-yl]quinoxaline-5-carbonitrile
CID 146276005
8-[2-methyl-6-[[4-[(8R)-8-methyl-5,6,7,8-tetrahydro-2,7-naphthyridin-3-yl]piperazin-1-yl]methyl]morpholin-4-yl]quinoxaline-5-carbonitrile
CID 146275941
5-[(2R,6R)-2-[[(3S)-3,4-dimethylpiperazin-1-yl]methyl]-6-methylmorpholin-4-yl]quinoline-8-carbonitrile
CID 118005811
5-[(2R,6R)-2-methyl-6-(morpholin-4-ylmethyl)morpholin-4-yl]quinoline-8-carbonitrile
CID 118006463

Frequently Asked Questions

What is the IUPAC name of (2R,6S)-2-methyl-6-[(4-methylpiperazin-1-yl)methyl]-4-pyrido[2,3-b]pyrazin-8-ylmorpholine?
The IUPAC name of (2R,6S)-2-methyl-6-[(4-methylpiperazin-1-yl)methyl]-4-pyrido[2,3-b]pyrazin-8-ylmorpholine (CID 129240999) is (2R,6S)-2-methyl-6-[(4-methylpiperazin-1-yl)methyl]-4-pyrido[2,3-b]pyrazin-8-ylmorpholine.
What is the SMILES notation for (2R,6S)-2-methyl-6-[(4-methylpiperazin-1-yl)methyl]-4-pyrido[2,3-b]pyrazin-8-ylmorpholine?
The canonical SMILES for (2R,6S)-2-methyl-6-[(4-methylpiperazin-1-yl)methyl]-4-pyrido[2,3-b]pyrazin-8-ylmorpholine is C[C@@H]1CN(c2ccnc3nccnc23)C[C@H](CN2CCN(C)CC2)O1.
What is the InChIKey of (2R,6S)-2-methyl-6-[(4-methylpiperazin-1-yl)methyl]-4-pyrido[2,3-b]pyrazin-8-ylmorpholine?
The InChIKey is GAQQPHSKJXIYEN-CABCVRRESA-N. The full InChI is InChI=1S/C18H26N6O/c1-14-11-24(16-3-4-20-18-17(16)19-5-6-21-18)13-15(25-14)12-23-9-7-22(2)8-10-23/h3-6,14-15H,7-13H2,1-2H3/t14-,15+/m1/s1.
What are the key properties of (2R,6S)-2-methyl-6-[(4-methylpiperazin-1-yl)methyl]-4-pyrido[2,3-b]pyrazin-8-ylmorpholine?
(2R,6S)-2-methyl-6-[(4-methylpiperazin-1-yl)methyl]-4-pyrido[2,3-b]pyrazin-8-ylmorpholine has a molecular weight of 342.45 g/mol, XLogP of 0.87, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,6S)-2-methyl-6-[(4-methylpiperazin-1-yl)methyl]-4-pyrido[2,3-b]pyrazin-8-ylmorpholine is sourced from PubChem (CID 129240999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).