3-cyclopentyl-6,7-dihydro-5H-[1,2]oxazolo[5,4-c]pyridin-4-one

C11H14N2O2 — CID 82395967

IUPAC3-cyclopentyl-6,7-dihydro-5H-[1,2]oxazolo[5,4-c]pyridin-4-one
SMILESO=C1CNCc2onc(C3CCCC3)c21
InChIInChI=1S/C11H14N2O2/c14-8-5-12-6-9-10(8)11(13-15-9)7-3-1-2-4-7/h7,12H,1-6H2
InChIKeyBDVBVRBQKXUTEH-UHFFFAOYSA-N
MW206.24 g/mol
LogP1.62
Rot. Bonds1

About 3-cyclopentyl-6,7-dihydro-5H-[1,2]oxazolo[5,4-c]pyridin-4-one

3-cyclopentyl-6,7-dihydro-5H-[1,2]oxazolo[5,4-c]pyridin-4-one (PubChem CID 82395967) has the molecular formula C11H14N2O2 and a molecular weight of 206.24 g/mol. Its IUPAC name is 3-cyclopentyl-6,7-dihydro-5H-[1,2]oxazolo[5,4-c]pyridin-4-one.

Molecular Properties

Compound Name3-cyclopentyl-6,7-dihydro-5H-[1,2]oxazolo[5,4-c]pyridin-4-one
PubChem CID82395967
Molecular FormulaC11H14N2O2
Molecular Weight206.24 g/mol
Exact Mass206.11
IUPAC Name3-cyclopentyl-6,7-dihydro-5H-[1,2]oxazolo[5,4-c]pyridin-4-one
SMILESO=C1CNCc2onc(C3CCCC3)c21
InChIInChI=1S/C11H14N2O2/c14-8-5-12-6-9-10(8)11(13-15-9)7-3-1-2-4-7/h7,12H,1-6H2
InChIKeyBDVBVRBQKXUTEH-UHFFFAOYSA-N
XLogP1.62
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.24
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyl-6,7-dihydro-5H-[1,2]oxazolo[5,4-c]pyridin-4-one?
The IUPAC name of 3-cyclopentyl-6,7-dihydro-5H-[1,2]oxazolo[5,4-c]pyridin-4-one (CID 82395967) is 3-cyclopentyl-6,7-dihydro-5H-[1,2]oxazolo[5,4-c]pyridin-4-one.
What is the SMILES notation for 3-cyclopentyl-6,7-dihydro-5H-[1,2]oxazolo[5,4-c]pyridin-4-one?
The canonical SMILES for 3-cyclopentyl-6,7-dihydro-5H-[1,2]oxazolo[5,4-c]pyridin-4-one is O=C1CNCc2onc(C3CCCC3)c21.
What is the InChIKey of 3-cyclopentyl-6,7-dihydro-5H-[1,2]oxazolo[5,4-c]pyridin-4-one?
The InChIKey is BDVBVRBQKXUTEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O2/c14-8-5-12-6-9-10(8)11(13-15-9)7-3-1-2-4-7/h7,12H,1-6H2.
What are the key properties of 3-cyclopentyl-6,7-dihydro-5H-[1,2]oxazolo[5,4-c]pyridin-4-one?
3-cyclopentyl-6,7-dihydro-5H-[1,2]oxazolo[5,4-c]pyridin-4-one has a molecular weight of 206.24 g/mol, XLogP of 1.62, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyl-6,7-dihydro-5H-[1,2]oxazolo[5,4-c]pyridin-4-one is sourced from PubChem (CID 82395967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).