(3S)-3-ethyl-4-[4-[(3R)-3-methylmorpholin-4-yl]-1,3,5-triazin-2-yl]morpholine

C14H23N5O2 — CID 175844619

IUPAC(3S)-3-ethyl-4-[4-[(3R)-3-methylmorpholin-4-yl]-1,3,5-triazin-2-yl]morpholine
SMILESCC[C@H]1COCCN1c1ncnc(N2CCOC[C@H]2C)n1
InChIInChI=1S/C14H23N5O2/c1-3-12-9-21-7-5-19(12)14-16-10-15-13(17-14)18-4-6-20-8-11(18)2/h10-12H,3-9H2,1-2H3/t11-,12+/m1/s1
InChIKeyKBUMXAUYLIBEMP-NEPJUHHUSA-N
MW293.37 g/mol
LogP0.71
Rot. Bonds3

About (3S)-3-ethyl-4-[4-[(3R)-3-methylmorpholin-4-yl]-1,3,5-triazin-2-yl]morpholine

(3S)-3-ethyl-4-[4-[(3R)-3-methylmorpholin-4-yl]-1,3,5-triazin-2-yl]morpholine (PubChem CID 175844619) has the molecular formula C14H23N5O2 and a molecular weight of 293.37 g/mol. Its IUPAC name is (3S)-3-ethyl-4-[4-[(3R)-3-methylmorpholin-4-yl]-1,3,5-triazin-2-yl]morpholine.

Molecular Properties

Compound Name(3S)-3-ethyl-4-[4-[(3R)-3-methylmorpholin-4-yl]-1,3,5-triazin-2-yl]morpholine
PubChem CID175844619
Molecular FormulaC14H23N5O2
Molecular Weight293.37 g/mol
Exact Mass293.19
IUPAC Name(3S)-3-ethyl-4-[4-[(3R)-3-methylmorpholin-4-yl]-1,3,5-triazin-2-yl]morpholine
SMILESCC[C@H]1COCCN1c1ncnc(N2CCOC[C@H]2C)n1
InChIInChI=1S/C14H23N5O2/c1-3-12-9-21-7-5-19(12)14-16-10-15-13(17-14)18-4-6-20-8-11(18)2/h10-12H,3-9H2,1-2H3/t11-,12+/m1/s1
InChIKeyKBUMXAUYLIBEMP-NEPJUHHUSA-N
XLogP0.71
TPSA63.61 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 50.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze (3S)-3-ethyl-4-[4-[(3R)-3-methylmorpholin-4-yl]-1,3,5-triazin-2-yl]morpholine with MolForge

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Related Compounds

4-(6-chloro-2-pyridinyl)-3-ethylmorpholine
CID 63585973
(3R)-4-[4-chloro-6-[(3R)-3-methylmorpholin-4-yl]-1,3,5-triazin-2-yl]-3-propylmorpholine
CID 139505136
(3R)-3-methyl-4-[4-methyl-6-[(3S)-3-methylmorpholin-4-yl]-1,3,5-triazin-2-yl]morpholine
CID 155440037
(3R)-3-methyl-4-[4-methyl-6-[(3R)-3-methylmorpholin-4-yl]-1,3,5-triazin-2-yl]morpholine
CID 155439964
4-[4-chloro-6-[(3S)-3-methylmorpholin-4-yl]-1,3,5-triazin-2-yl]-3-methylmorpholine
CID 139520999
4-(4-chloro-6-pyrazol-1-yl-1,3,5-triazin-2-yl)-3-ethylmorpholine
CID 62864402
4-(4-chloro-1,3-thiazol-2-yl)-3-ethylmorpholine
CID 83157051
4-(5-bromo-2-pyridinyl)-3-ethylmorpholine
CID 61375479
4-(5-chloro-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-3-ethylmorpholine
CID 102918480
4-(4-chloro-6-imidazol-1-yl-1,3,5-triazin-2-yl)-3-ethylmorpholine
CID 62864577
6-(3-ethylmorpholin-4-yl)-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine
CID 80789304
5-ethyl-6-(3-methylmorpholin-4-yl)pyrimidin-4-amine
CID 80780913

Frequently Asked Questions

What is the IUPAC name of (3S)-3-ethyl-4-[4-[(3R)-3-methylmorpholin-4-yl]-1,3,5-triazin-2-yl]morpholine?
The IUPAC name of (3S)-3-ethyl-4-[4-[(3R)-3-methylmorpholin-4-yl]-1,3,5-triazin-2-yl]morpholine (CID 175844619) is (3S)-3-ethyl-4-[4-[(3R)-3-methylmorpholin-4-yl]-1,3,5-triazin-2-yl]morpholine.
What is the SMILES notation for (3S)-3-ethyl-4-[4-[(3R)-3-methylmorpholin-4-yl]-1,3,5-triazin-2-yl]morpholine?
The canonical SMILES for (3S)-3-ethyl-4-[4-[(3R)-3-methylmorpholin-4-yl]-1,3,5-triazin-2-yl]morpholine is CC[C@H]1COCCN1c1ncnc(N2CCOC[C@H]2C)n1.
What is the InChIKey of (3S)-3-ethyl-4-[4-[(3R)-3-methylmorpholin-4-yl]-1,3,5-triazin-2-yl]morpholine?
The InChIKey is KBUMXAUYLIBEMP-NEPJUHHUSA-N. The full InChI is InChI=1S/C14H23N5O2/c1-3-12-9-21-7-5-19(12)14-16-10-15-13(17-14)18-4-6-20-8-11(18)2/h10-12H,3-9H2,1-2H3/t11-,12+/m1/s1.
What are the key properties of (3S)-3-ethyl-4-[4-[(3R)-3-methylmorpholin-4-yl]-1,3,5-triazin-2-yl]morpholine?
(3S)-3-ethyl-4-[4-[(3R)-3-methylmorpholin-4-yl]-1,3,5-triazin-2-yl]morpholine has a molecular weight of 293.37 g/mol, XLogP of 0.71, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-3-ethyl-4-[4-[(3R)-3-methylmorpholin-4-yl]-1,3,5-triazin-2-yl]morpholine is sourced from PubChem (CID 175844619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).