[(2R,6R)-2-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-6-methylmorpholin-4-yl]-(4,5,6,7-tetrahydro-1H-indol-2-yl)methanone

C19H24N4O3 — CID 154761710

IUPAC[(2R,6R)-2-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-6-methylmorpholin-4-yl]-(4,5,6,7-tetrahydro-1H-indol-2-yl)methanone
SMILESC[C@@H]1CN(C(=O)c2cc3c([nH]2)CCCC3)C[C@H](c2nc(C3CC3)no2)O1
InChIInChI=1S/C19H24N4O3/c1-11-9-23(19(24)15-8-13-4-2-3-5-14(13)20-15)10-16(25-11)18-21-17(22-26-18)12-6-7-12/h8,11-12,16,20H,2-7,9-10H2,1H3/t11-,16-/m1/s1
InChIKeyVXALFVHYBFRDQO-BDJLRTHQSA-N
MW356.43 g/mol
LogP2.76
Rot. Bonds3

About [(2R,6R)-2-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-6-methylmorpholin-4-yl]-(4,5,6,7-tetrahydro-1H-indol-2-yl)methanone

[(2R,6R)-2-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-6-methylmorpholin-4-yl]-(4,5,6,7-tetrahydro-1H-indol-2-yl)methanone (PubChem CID 154761710) has the molecular formula C19H24N4O3 and a molecular weight of 356.43 g/mol. Its IUPAC name is [(2R,6R)-2-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-6-methylmorpholin-4-yl]-(4,5,6,7-tetrahydro-1H-indol-2-yl)methanone.

Molecular Properties

Compound Name[(2R,6R)-2-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-6-methylmorpholin-4-yl]-(4,5,6,7-tetrahydro-1H-indol-2-yl)methanone
PubChem CID154761710
Molecular FormulaC19H24N4O3
Molecular Weight356.43 g/mol
Exact Mass356.18
IUPAC Name[(2R,6R)-2-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-6-methylmorpholin-4-yl]-(4,5,6,7-tetrahydro-1H-indol-2-yl)methanone
SMILESC[C@@H]1CN(C(=O)c2cc3c([nH]2)CCCC3)C[C@H](c2nc(C3CC3)no2)O1
InChIInChI=1S/C19H24N4O3/c1-11-9-23(19(24)15-8-13-4-2-3-5-14(13)20-15)10-16(25-11)18-21-17(22-26-18)12-6-7-12/h8,11-12,16,20H,2-7,9-10H2,1H3/t11-,16-/m1/s1
InChIKeyVXALFVHYBFRDQO-BDJLRTHQSA-N
XLogP2.76
TPSA84.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.43
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze [(2R,6R)-2-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-6-methylmorpholin-4-yl]-(4,5,6,7-tetrahydro-1H-indol-2-yl)methanone with MolForge

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Related Compounds

(3,4-dimethylpiperazin-1-yl)-(4,5,6,7-tetrahydro-1H-indol-2-yl)methanone
CID 70938079
(2R,6R)-2-methyl-6-(3-methyl-1,2,4-oxadiazol-5-yl)morpholine-4-carboxamide
CID 146082113
[3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)azetidin-1-yl]-(2,5-dimethylfuran-3-yl)methanone
CID 71783568
[3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)azetidin-1-yl]-(3,4,5-triethoxyphenyl)methanone
CID 121092566
1-[2-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)morpholin-4-yl]ethanone
CID 166257079
[3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)azetidin-1-yl]-(4-phenylphenyl)methanone
CID 56764452
(2R,6R)-N-[2-(2-cyclopropylpyrimidin-5-yl)ethyl]-2-methyl-6-(3-methyl-1,2,4-oxadiazol-5-yl)morpholine-4-carboxamide
CID 126825314
[3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)azetidin-1-yl]-(3,4-difluorophenyl)methanone
CID 121092577
(3-bromophenyl)-[3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)azetidin-1-yl]methanone
CID 121092573
3-[3-[3-(2-methylpropyl)-1,2,4-oxadiazol-5-yl]piperidine-1-carbonyl]-1,5,6,7-tetrahydrocyclopenta[b]pyridin-2-one
CID 91778298
(3S,4S)-4-methyl-1-(2-oxo-1,5,6,7,8,9-hexahydrocyclohepta[b]pyridine-3-carbonyl)pyrrolidine-3-carboxylic acid
CID 120953298
(5-chloro-2-methoxyphenyl)-[3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)azetidin-1-yl]methanone
CID 71783565

Frequently Asked Questions

What is the IUPAC name of [(2R,6R)-2-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-6-methylmorpholin-4-yl]-(4,5,6,7-tetrahydro-1H-indol-2-yl)methanone?
The IUPAC name of [(2R,6R)-2-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-6-methylmorpholin-4-yl]-(4,5,6,7-tetrahydro-1H-indol-2-yl)methanone (CID 154761710) is [(2R,6R)-2-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-6-methylmorpholin-4-yl]-(4,5,6,7-tetrahydro-1H-indol-2-yl)methanone.
What is the SMILES notation for [(2R,6R)-2-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-6-methylmorpholin-4-yl]-(4,5,6,7-tetrahydro-1H-indol-2-yl)methanone?
The canonical SMILES for [(2R,6R)-2-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-6-methylmorpholin-4-yl]-(4,5,6,7-tetrahydro-1H-indol-2-yl)methanone is C[C@@H]1CN(C(=O)c2cc3c([nH]2)CCCC3)C[C@H](c2nc(C3CC3)no2)O1.
What is the InChIKey of [(2R,6R)-2-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-6-methylmorpholin-4-yl]-(4,5,6,7-tetrahydro-1H-indol-2-yl)methanone?
The InChIKey is VXALFVHYBFRDQO-BDJLRTHQSA-N. The full InChI is InChI=1S/C19H24N4O3/c1-11-9-23(19(24)15-8-13-4-2-3-5-14(13)20-15)10-16(25-11)18-21-17(22-26-18)12-6-7-12/h8,11-12,16,20H,2-7,9-10H2,1H3/t11-,16-/m1/s1.
What are the key properties of [(2R,6R)-2-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-6-methylmorpholin-4-yl]-(4,5,6,7-tetrahydro-1H-indol-2-yl)methanone?
[(2R,6R)-2-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-6-methylmorpholin-4-yl]-(4,5,6,7-tetrahydro-1H-indol-2-yl)methanone has a molecular weight of 356.43 g/mol, XLogP of 2.76, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R,6R)-2-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-6-methylmorpholin-4-yl]-(4,5,6,7-tetrahydro-1H-indol-2-yl)methanone is sourced from PubChem (CID 154761710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).