[(2S)-2-[[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]morpholin-4-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone

C18H21N5O4 — CID 97148139

IUPAC[(2S)-2-[[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]morpholin-4-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone
SMILESCOCc1noc(C[C@H]2CN(C(=O)c3cn4cc(C)ccc4n3)CCO2)n1
InChIInChI=1S/C18H21N5O4/c1-12-3-4-16-19-14(10-23(16)8-12)18(24)22-5-6-26-13(9-22)7-17-20-15(11-25-2)21-27-17/h3-4,8,10,13H,5-7,9,11H2,1-2H3/t13-/m0/s1
InChIKeyXAHCMDDZGBIWLM-ZDUSSCGKSA-N
MW371.40 g/mol
LogP1.26
Rot. Bonds5

About [(2S)-2-[[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]morpholin-4-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone

[(2S)-2-[[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]morpholin-4-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone (PubChem CID 97148139) has the molecular formula C18H21N5O4 and a molecular weight of 371.40 g/mol. Its IUPAC name is [(2S)-2-[[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]morpholin-4-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone.

Molecular Properties

Compound Name[(2S)-2-[[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]morpholin-4-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone
PubChem CID97148139
Molecular FormulaC18H21N5O4
Molecular Weight371.40 g/mol
Exact Mass371.16
IUPAC Name[(2S)-2-[[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]morpholin-4-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone
SMILESCOCc1noc(C[C@H]2CN(C(=O)c3cn4cc(C)ccc4n3)CCO2)n1
InChIInChI=1S/C18H21N5O4/c1-12-3-4-16-19-14(10-23(16)8-12)18(24)22-5-6-26-13(9-22)7-17-20-15(11-25-2)21-27-17/h3-4,8,10,13H,5-7,9,11H2,1-2H3/t13-/m0/s1
InChIKeyXAHCMDDZGBIWLM-ZDUSSCGKSA-N
XLogP1.26
TPSA94.99 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.40
LogP ≤ 51.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

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Related Compounds

2,3-dihydro-1,4-benzodioxin-6-yl-[(2R)-2-[[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]morpholin-4-yl]methanone
CID 97434480
1-[4-[(2R)-2-[[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]morpholine-4-carbonyl]thiophen-2-yl]ethanone
CID 97451805
[5-[(E)-but-2-enyl]-1,3,4-oxadiazol-2-yl]-[2-[[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]morpholin-4-yl]methanone
CID 56875485
1-[2-[[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]morpholin-4-yl]-3-(1-methylpyrazol-4-yl)propan-1-one
CID 74241951
(6-methylimidazo[1,2-a]pyridin-2-yl)-[2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]methanone
CID 110105201
2-[[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]-4-(5-methylpyrazolo[1,5-a]pyrimidin-7-yl)morpholine
CID 56883063
2-[4-(5-methylimidazo[1,2-a]pyridine-2-carbonyl)morpholin-2-yl]acetic acid
CID 102554769
[(2S)-2-[(4-methoxyphenyl)methyl]morpholin-4-yl]-(2-methyl-1,3-oxazol-4-yl)methanone
CID 124944341
1-ethyl-1-[[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]urea
CID 119070528
(2R)-2-[[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]-4-(1H-pyrrolo[2,3-b]pyridin-6-yl)morpholine
CID 95708943
(3S,4R)-4-hydroxy-N-[[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]-1-(6-methylpyrazolo[1,5-a]pyridine-3-carbonyl)piperidine-3-carboxamide
CID 169413915
(6-methylimidazo[1,2-a]pyridin-2-yl)-[(3R)-3-(pyridin-2-ylmethoxy)piperidin-1-yl]methanone
CID 97142061

Frequently Asked Questions

What is the IUPAC name of [(2S)-2-[[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]morpholin-4-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone?
The IUPAC name of [(2S)-2-[[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]morpholin-4-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone (CID 97148139) is [(2S)-2-[[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]morpholin-4-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone.
What is the SMILES notation for [(2S)-2-[[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]morpholin-4-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone?
The canonical SMILES for [(2S)-2-[[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]morpholin-4-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone is COCc1noc(C[C@H]2CN(C(=O)c3cn4cc(C)ccc4n3)CCO2)n1.
What is the InChIKey of [(2S)-2-[[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]morpholin-4-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone?
The InChIKey is XAHCMDDZGBIWLM-ZDUSSCGKSA-N. The full InChI is InChI=1S/C18H21N5O4/c1-12-3-4-16-19-14(10-23(16)8-12)18(24)22-5-6-26-13(9-22)7-17-20-15(11-25-2)21-27-17/h3-4,8,10,13H,5-7,9,11H2,1-2H3/t13-/m0/s1.
What are the key properties of [(2S)-2-[[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]morpholin-4-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone?
[(2S)-2-[[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]morpholin-4-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone has a molecular weight of 371.40 g/mol, XLogP of 1.26, 5 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for [(2S)-2-[[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]morpholin-4-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone is sourced from PubChem (CID 97148139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).