(6S)-4-(imidazo[1,2-a]pyrazin-3-ylmethyl)-6-(methoxymethyl)-2,2-dimethylmorpholine

C15H22N4O2 — CID 129482791

IUPAC(6S)-4-(imidazo[1,2-a]pyrazin-3-ylmethyl)-6-(methoxymethyl)-2,2-dimethylmorpholine
SMILESCOC[C@@H]1CN(Cc2cnc3cnccn23)CC(C)(C)O1
InChIInChI=1S/C15H22N4O2/c1-15(2)11-18(9-13(21-15)10-20-3)8-12-6-17-14-7-16-4-5-19(12)14/h4-7,13H,8-11H2,1-3H3/t13-/m0/s1
InChIKeyKZCPBTULVUPFQP-ZDUSSCGKSA-N
MW290.37 g/mol
LogP1.36
Rot. Bonds4

About (6S)-4-(imidazo[1,2-a]pyrazin-3-ylmethyl)-6-(methoxymethyl)-2,2-dimethylmorpholine

(6S)-4-(imidazo[1,2-a]pyrazin-3-ylmethyl)-6-(methoxymethyl)-2,2-dimethylmorpholine (PubChem CID 129482791) has the molecular formula C15H22N4O2 and a molecular weight of 290.37 g/mol. Its IUPAC name is (6S)-4-(imidazo[1,2-a]pyrazin-3-ylmethyl)-6-(methoxymethyl)-2,2-dimethylmorpholine.

Molecular Properties

Compound Name(6S)-4-(imidazo[1,2-a]pyrazin-3-ylmethyl)-6-(methoxymethyl)-2,2-dimethylmorpholine
PubChem CID129482791
Molecular FormulaC15H22N4O2
Molecular Weight290.37 g/mol
Exact Mass290.17
IUPAC Name(6S)-4-(imidazo[1,2-a]pyrazin-3-ylmethyl)-6-(methoxymethyl)-2,2-dimethylmorpholine
SMILESCOC[C@@H]1CN(Cc2cnc3cnccn23)CC(C)(C)O1
InChIInChI=1S/C15H22N4O2/c1-15(2)11-18(9-13(21-15)10-20-3)8-12-6-17-14-7-16-4-5-19(12)14/h4-7,13H,8-11H2,1-3H3/t13-/m0/s1
InChIKeyKZCPBTULVUPFQP-ZDUSSCGKSA-N
XLogP1.36
TPSA51.89 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 51.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

(6S)-6-(methoxymethyl)-2,2-dimethyl-4-(pyrimidin-2-ylmethyl)morpholine
CID 129350850
(6R)-6-(methoxymethyl)-2,2-dimethyl-4-(pyrimidin-2-ylmethyl)morpholine
CID 129350849
(6S)-6-(methoxymethyl)-2,2-dimethyl-4-[(3-methyltriazol-4-yl)methyl]morpholine
CID 129491465
4-[[6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]methyl]pyridin-2-amine
CID 128975935
(6S)-4-[(2-ethyl-1,2,4-triazol-3-yl)methyl]-6-(methoxymethyl)-2,2-dimethylmorpholine
CID 129345524
(6S)-4-[(2,6-dichlorophenyl)methyl]-6-(methoxymethyl)-2,2-dimethylmorpholine
CID 167885794
4-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-6-(methoxymethyl)-2,2-dimethylmorpholine
CID 128978245
(6R)-6-(methoxymethyl)-2,2-dimethyl-4-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl]morpholine
CID 129345533
6-(methoxymethyl)-2,2-dimethyl-4-[(3-methylquinoxalin-2-yl)methyl]morpholine
CID 128978215
(6R)-6-(methoxymethyl)-2,2-dimethyl-4-[[2-(2-methylpropyl)-1,2,4-triazol-3-yl]methyl]morpholine
CID 129345619
(6R)-6-(methoxymethyl)-2,2-dimethyl-4-(1,6-naphthyridin-4-yl)morpholine
CID 129482266
(6R)-4-[[5-(2-fluorophenyl)-1,3-oxazol-2-yl]methyl]-6-(methoxymethyl)-2,2-dimethylmorpholine
CID 129483204

Frequently Asked Questions

What is the IUPAC name of (6S)-4-(imidazo[1,2-a]pyrazin-3-ylmethyl)-6-(methoxymethyl)-2,2-dimethylmorpholine?
The IUPAC name of (6S)-4-(imidazo[1,2-a]pyrazin-3-ylmethyl)-6-(methoxymethyl)-2,2-dimethylmorpholine (CID 129482791) is (6S)-4-(imidazo[1,2-a]pyrazin-3-ylmethyl)-6-(methoxymethyl)-2,2-dimethylmorpholine.
What is the SMILES notation for (6S)-4-(imidazo[1,2-a]pyrazin-3-ylmethyl)-6-(methoxymethyl)-2,2-dimethylmorpholine?
The canonical SMILES for (6S)-4-(imidazo[1,2-a]pyrazin-3-ylmethyl)-6-(methoxymethyl)-2,2-dimethylmorpholine is COC[C@@H]1CN(Cc2cnc3cnccn23)CC(C)(C)O1.
What is the InChIKey of (6S)-4-(imidazo[1,2-a]pyrazin-3-ylmethyl)-6-(methoxymethyl)-2,2-dimethylmorpholine?
The InChIKey is KZCPBTULVUPFQP-ZDUSSCGKSA-N. The full InChI is InChI=1S/C15H22N4O2/c1-15(2)11-18(9-13(21-15)10-20-3)8-12-6-17-14-7-16-4-5-19(12)14/h4-7,13H,8-11H2,1-3H3/t13-/m0/s1.
What are the key properties of (6S)-4-(imidazo[1,2-a]pyrazin-3-ylmethyl)-6-(methoxymethyl)-2,2-dimethylmorpholine?
(6S)-4-(imidazo[1,2-a]pyrazin-3-ylmethyl)-6-(methoxymethyl)-2,2-dimethylmorpholine has a molecular weight of 290.37 g/mol, XLogP of 1.36, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (6S)-4-(imidazo[1,2-a]pyrazin-3-ylmethyl)-6-(methoxymethyl)-2,2-dimethylmorpholine is sourced from PubChem (CID 129482791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).