7-[(2S)-2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)piperidine-1-carbonyl]-1H-pyrido[2,3-b][1,4]oxazin-2-one

C18H19N5O4 — CID 164638523

IUPAC7-[(2S)-2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)piperidine-1-carbonyl]-1H-pyrido[2,3-b][1,4]oxazin-2-one
SMILESO=C1COc2ncc(C(=O)N3CCCC[C@H]3c3noc(C4CC4)n3)cc2N1
InChIInChI=1S/C18H19N5O4/c24-14-9-26-17-12(20-14)7-11(8-19-17)18(25)23-6-2-1-3-13(23)15-21-16(27-22-15)10-4-5-10/h7-8,10,13H,1-6,9H2,(H,20,24)/t13-/m0/s1
InChIKeyYKYOGSARJQOJNO-ZDUSSCGKSA-N
MW369.38 g/mol
LogP2.04
Rot. Bonds3

About 7-[(2S)-2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)piperidine-1-carbonyl]-1H-pyrido[2,3-b][1,4]oxazin-2-one

7-[(2S)-2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)piperidine-1-carbonyl]-1H-pyrido[2,3-b][1,4]oxazin-2-one (PubChem CID 164638523) has the molecular formula C18H19N5O4 and a molecular weight of 369.38 g/mol. Its IUPAC name is 7-[(2S)-2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)piperidine-1-carbonyl]-1H-pyrido[2,3-b][1,4]oxazin-2-one.

Molecular Properties

Compound Name7-[(2S)-2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)piperidine-1-carbonyl]-1H-pyrido[2,3-b][1,4]oxazin-2-one
PubChem CID164638523
Molecular FormulaC18H19N5O4
Molecular Weight369.38 g/mol
Exact Mass369.14
IUPAC Name7-[(2S)-2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)piperidine-1-carbonyl]-1H-pyrido[2,3-b][1,4]oxazin-2-one
SMILESO=C1COc2ncc(C(=O)N3CCCC[C@H]3c3noc(C4CC4)n3)cc2N1
InChIInChI=1S/C18H19N5O4/c24-14-9-26-17-12(20-14)7-11(8-19-17)18(25)23-6-2-1-3-13(23)15-21-16(27-22-15)10-4-5-10/h7-8,10,13H,1-6,9H2,(H,20,24)/t13-/m0/s1
InChIKeyYKYOGSARJQOJNO-ZDUSSCGKSA-N
XLogP2.04
TPSA110.45 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.38
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 7-[(2S)-2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)piperidine-1-carbonyl]-1H-pyrido[2,3-b][1,4]oxazin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-[(2S)-2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)pyrrolidine-1-carbonyl]-1,3-dihydrobenzimidazol-2-one
CID 97013190
[(2R)-2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)pyrrolidin-1-yl]-(2,3-dihydro-1,4-benzodioxin-6-yl)methanone
CID 97013185
[2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)pyrrolidin-1-yl]-(2-methyl-1H-imidazol-5-yl)methanone
CID 71928015
[(2S)-2-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-(furan-3-yl)methanone
CID 95110723
3-[(2R)-2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)pyrrolidine-1-carbonyl]benzonitrile
CID 97011039
3-[(2S)-2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)pyrrolidine-1-carbonyl]benzonitrile
CID 97011040
1-cyclopropyl-4-[2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)pyrrolidine-1-carbonyl]pyrrolidin-2-one
CID 71872964
[(2R)-2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)pyrrolidin-1-yl]-(2,5-dimethylthiophen-3-yl)methanone
CID 97003510
[(2R)-2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)pyrrolidin-1-yl]-(2,5-dimethylfuran-3-yl)methanone
CID 97003434
[2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)pyrrolidin-1-yl]-(2,5-dimethylthiophen-3-yl)methanone
CID 71928919
[2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)pyrrolidin-1-yl]-(1,5-dimethylpyrazol-4-yl)methanone
CID 167789568
(3-methyl-[1,2]oxazolo[5,4-b]pyridin-5-yl)-[(2S)-2-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)azepan-1-yl]methanone
CID 97345489

Frequently Asked Questions

What is the IUPAC name of 7-[(2S)-2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)piperidine-1-carbonyl]-1H-pyrido[2,3-b][1,4]oxazin-2-one?
The IUPAC name of 7-[(2S)-2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)piperidine-1-carbonyl]-1H-pyrido[2,3-b][1,4]oxazin-2-one (CID 164638523) is 7-[(2S)-2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)piperidine-1-carbonyl]-1H-pyrido[2,3-b][1,4]oxazin-2-one.
What is the SMILES notation for 7-[(2S)-2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)piperidine-1-carbonyl]-1H-pyrido[2,3-b][1,4]oxazin-2-one?
The canonical SMILES for 7-[(2S)-2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)piperidine-1-carbonyl]-1H-pyrido[2,3-b][1,4]oxazin-2-one is O=C1COc2ncc(C(=O)N3CCCC[C@H]3c3noc(C4CC4)n3)cc2N1.
What is the InChIKey of 7-[(2S)-2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)piperidine-1-carbonyl]-1H-pyrido[2,3-b][1,4]oxazin-2-one?
The InChIKey is YKYOGSARJQOJNO-ZDUSSCGKSA-N. The full InChI is InChI=1S/C18H19N5O4/c24-14-9-26-17-12(20-14)7-11(8-19-17)18(25)23-6-2-1-3-13(23)15-21-16(27-22-15)10-4-5-10/h7-8,10,13H,1-6,9H2,(H,20,24)/t13-/m0/s1.
What are the key properties of 7-[(2S)-2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)piperidine-1-carbonyl]-1H-pyrido[2,3-b][1,4]oxazin-2-one?
7-[(2S)-2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)piperidine-1-carbonyl]-1H-pyrido[2,3-b][1,4]oxazin-2-one has a molecular weight of 369.38 g/mol, XLogP of 2.04, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[(2S)-2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)piperidine-1-carbonyl]-1H-pyrido[2,3-b][1,4]oxazin-2-one is sourced from PubChem (CID 164638523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).