(5-methyl-1,2-oxazol-4-yl)-(2-morpholin-4-yl-7-azaspiro[3.5]nonan-7-yl)methanone

C17H25N3O3 — CID 97385671

IUPAC(5-methyl-1,2-oxazol-4-yl)-(2-morpholin-4-yl-7-azaspiro[3.5]nonan-7-yl)methanone
SMILESCc1oncc1C(=O)N1CCC2(CC1)CC(N1CCOCC1)C2
InChIInChI=1S/C17H25N3O3/c1-13-15(12-18-23-13)16(21)20-4-2-17(3-5-20)10-14(11-17)19-6-8-22-9-7-19/h12,14H,2-11H2,1H3
InChIKeyGUXJPERNPWSBFV-UHFFFAOYSA-N
MW319.40 g/mol
LogP1.70
Rot. Bonds2

About (5-methyl-1,2-oxazol-4-yl)-(2-morpholin-4-yl-7-azaspiro[3.5]nonan-7-yl)methanone

(5-methyl-1,2-oxazol-4-yl)-(2-morpholin-4-yl-7-azaspiro[3.5]nonan-7-yl)methanone (PubChem CID 97385671) has the molecular formula C17H25N3O3 and a molecular weight of 319.40 g/mol. Its IUPAC name is (5-methyl-1,2-oxazol-4-yl)-(2-morpholin-4-yl-7-azaspiro[3.5]nonan-7-yl)methanone.

Molecular Properties

Compound Name(5-methyl-1,2-oxazol-4-yl)-(2-morpholin-4-yl-7-azaspiro[3.5]nonan-7-yl)methanone
PubChem CID97385671
Molecular FormulaC17H25N3O3
Molecular Weight319.40 g/mol
Exact Mass319.19
IUPAC Name(5-methyl-1,2-oxazol-4-yl)-(2-morpholin-4-yl-7-azaspiro[3.5]nonan-7-yl)methanone
SMILESCc1oncc1C(=O)N1CCC2(CC1)CC(N1CCOCC1)C2
InChIInChI=1S/C17H25N3O3/c1-13-15(12-18-23-13)16(21)20-4-2-17(3-5-20)10-14(11-17)19-6-8-22-9-7-19/h12,14H,2-11H2,1H3
InChIKeyGUXJPERNPWSBFV-UHFFFAOYSA-N
XLogP1.70
TPSA58.81 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.40
LogP ≤ 51.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (5-methyl-1,2-oxazol-4-yl)-(2-morpholin-4-yl-7-azaspiro[3.5]nonan-7-yl)methanone?
The IUPAC name of (5-methyl-1,2-oxazol-4-yl)-(2-morpholin-4-yl-7-azaspiro[3.5]nonan-7-yl)methanone (CID 97385671) is (5-methyl-1,2-oxazol-4-yl)-(2-morpholin-4-yl-7-azaspiro[3.5]nonan-7-yl)methanone.
What is the SMILES notation for (5-methyl-1,2-oxazol-4-yl)-(2-morpholin-4-yl-7-azaspiro[3.5]nonan-7-yl)methanone?
The canonical SMILES for (5-methyl-1,2-oxazol-4-yl)-(2-morpholin-4-yl-7-azaspiro[3.5]nonan-7-yl)methanone is Cc1oncc1C(=O)N1CCC2(CC1)CC(N1CCOCC1)C2.
What is the InChIKey of (5-methyl-1,2-oxazol-4-yl)-(2-morpholin-4-yl-7-azaspiro[3.5]nonan-7-yl)methanone?
The InChIKey is GUXJPERNPWSBFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O3/c1-13-15(12-18-23-13)16(21)20-4-2-17(3-5-20)10-14(11-17)19-6-8-22-9-7-19/h12,14H,2-11H2,1H3.
What are the key properties of (5-methyl-1,2-oxazol-4-yl)-(2-morpholin-4-yl-7-azaspiro[3.5]nonan-7-yl)methanone?
(5-methyl-1,2-oxazol-4-yl)-(2-morpholin-4-yl-7-azaspiro[3.5]nonan-7-yl)methanone has a molecular weight of 319.40 g/mol, XLogP of 1.70, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (5-methyl-1,2-oxazol-4-yl)-(2-morpholin-4-yl-7-azaspiro[3.5]nonan-7-yl)methanone is sourced from PubChem (CID 97385671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).