(2R)-2,4-dimethyl-6-[[(2S)-4-methyl-5-[[(3S)-4-methylmorpholin-3-yl]methoxymethyl]morpholin-2-yl]methyl]morpholine

C19H37N3O4 — CID 137453929

IUPAC(2R)-2,4-dimethyl-6-[[(2S)-4-methyl-5-[[(3S)-4-methylmorpholin-3-yl]methoxymethyl]morpholin-2-yl]methyl]morpholine
SMILESC[C@@H]1CN(C)CC(C[C@H]2CN(C)C(COC[C@@H]3COCCN3C)CO2)O1
InChIInChI=1S/C19H37N3O4/c1-15-8-20(2)9-19(26-15)7-18-10-22(4)17(14-25-18)13-24-12-16-11-23-6-5-21(16)3/h15-19H,5-14H2,1-4H3/t15-,16+,17?,18+,19?/m1/s1
InChIKeyVRXACHMCZMOHRJ-OZKXEBFESA-N
MW371.52 g/mol
LogP0.14
Rot. Bonds6

About (2R)-2,4-dimethyl-6-[[(2S)-4-methyl-5-[[(3S)-4-methylmorpholin-3-yl]methoxymethyl]morpholin-2-yl]methyl]morpholine

(2R)-2,4-dimethyl-6-[[(2S)-4-methyl-5-[[(3S)-4-methylmorpholin-3-yl]methoxymethyl]morpholin-2-yl]methyl]morpholine (PubChem CID 137453929) has the molecular formula C19H37N3O4 and a molecular weight of 371.52 g/mol. Its IUPAC name is (2R)-2,4-dimethyl-6-[[(2S)-4-methyl-5-[[(3S)-4-methylmorpholin-3-yl]methoxymethyl]morpholin-2-yl]methyl]morpholine.

Molecular Properties

Compound Name(2R)-2,4-dimethyl-6-[[(2S)-4-methyl-5-[[(3S)-4-methylmorpholin-3-yl]methoxymethyl]morpholin-2-yl]methyl]morpholine
PubChem CID137453929
Molecular FormulaC19H37N3O4
Molecular Weight371.52 g/mol
Exact Mass371.28
IUPAC Name(2R)-2,4-dimethyl-6-[[(2S)-4-methyl-5-[[(3S)-4-methylmorpholin-3-yl]methoxymethyl]morpholin-2-yl]methyl]morpholine
SMILESC[C@@H]1CN(C)CC(C[C@H]2CN(C)C(COC[C@@H]3COCCN3C)CO2)O1
InChIInChI=1S/C19H37N3O4/c1-15-8-20(2)9-19(26-15)7-18-10-22(4)17(14-25-18)13-24-12-16-11-23-6-5-21(16)3/h15-19H,5-14H2,1-4H3/t15-,16+,17?,18+,19?/m1/s1
InChIKeyVRXACHMCZMOHRJ-OZKXEBFESA-N
XLogP0.14
TPSA46.64 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.52
LogP ≤ 50.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of (2R)-2,4-dimethyl-6-[[(2S)-4-methyl-5-[[(3S)-4-methylmorpholin-3-yl]methoxymethyl]morpholin-2-yl]methyl]morpholine?
The IUPAC name of (2R)-2,4-dimethyl-6-[[(2S)-4-methyl-5-[[(3S)-4-methylmorpholin-3-yl]methoxymethyl]morpholin-2-yl]methyl]morpholine (CID 137453929) is (2R)-2,4-dimethyl-6-[[(2S)-4-methyl-5-[[(3S)-4-methylmorpholin-3-yl]methoxymethyl]morpholin-2-yl]methyl]morpholine.
What is the SMILES notation for (2R)-2,4-dimethyl-6-[[(2S)-4-methyl-5-[[(3S)-4-methylmorpholin-3-yl]methoxymethyl]morpholin-2-yl]methyl]morpholine?
The canonical SMILES for (2R)-2,4-dimethyl-6-[[(2S)-4-methyl-5-[[(3S)-4-methylmorpholin-3-yl]methoxymethyl]morpholin-2-yl]methyl]morpholine is C[C@@H]1CN(C)CC(C[C@H]2CN(C)C(COC[C@@H]3COCCN3C)CO2)O1.
What is the InChIKey of (2R)-2,4-dimethyl-6-[[(2S)-4-methyl-5-[[(3S)-4-methylmorpholin-3-yl]methoxymethyl]morpholin-2-yl]methyl]morpholine?
The InChIKey is VRXACHMCZMOHRJ-OZKXEBFESA-N. The full InChI is InChI=1S/C19H37N3O4/c1-15-8-20(2)9-19(26-15)7-18-10-22(4)17(14-25-18)13-24-12-16-11-23-6-5-21(16)3/h15-19H,5-14H2,1-4H3/t15-,16+,17?,18+,19?/m1/s1.
What are the key properties of (2R)-2,4-dimethyl-6-[[(2S)-4-methyl-5-[[(3S)-4-methylmorpholin-3-yl]methoxymethyl]morpholin-2-yl]methyl]morpholine?
(2R)-2,4-dimethyl-6-[[(2S)-4-methyl-5-[[(3S)-4-methylmorpholin-3-yl]methoxymethyl]morpholin-2-yl]methyl]morpholine has a molecular weight of 371.52 g/mol, XLogP of 0.14, 6 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2,4-dimethyl-6-[[(2S)-4-methyl-5-[[(3S)-4-methylmorpholin-3-yl]methoxymethyl]morpholin-2-yl]methyl]morpholine is sourced from PubChem (CID 137453929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).