N-([1,2]oxazolo[5,4-b]pyridin-3-yl)propanamide

C9H9N3O2 — CID 42110353

IUPACN-([1,2]oxazolo[5,4-b]pyridin-3-yl)propanamide
SMILESCCC(=O)Nc1noc2ncccc12
InChIInChI=1S/C9H9N3O2/c1-2-7(13)11-8-6-4-3-5-10-9(6)14-12-8/h3-5H,2H2,1H3,(H,11,12,13)
InChIKeyLPKYLYQRZGIMAL-UHFFFAOYSA-N
MW191.19 g/mol
LogP1.57
Rot. Bonds2

About N-([1,2]oxazolo[5,4-b]pyridin-3-yl)propanamide

N-([1,2]oxazolo[5,4-b]pyridin-3-yl)propanamide (PubChem CID 42110353) has the molecular formula C9H9N3O2 and a molecular weight of 191.19 g/mol. Its IUPAC name is N-([1,2]oxazolo[5,4-b]pyridin-3-yl)propanamide.

Molecular Properties

Compound NameN-([1,2]oxazolo[5,4-b]pyridin-3-yl)propanamide
PubChem CID42110353
Molecular FormulaC9H9N3O2
Molecular Weight191.19 g/mol
Exact Mass191.07
IUPAC NameN-([1,2]oxazolo[5,4-b]pyridin-3-yl)propanamide
SMILESCCC(=O)Nc1noc2ncccc12
InChIInChI=1S/C9H9N3O2/c1-2-7(13)11-8-6-4-3-5-10-9(6)14-12-8/h3-5H,2H2,1H3,(H,11,12,13)
InChIKeyLPKYLYQRZGIMAL-UHFFFAOYSA-N
XLogP1.57
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.19
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-([1,2]oxazolo[5,4-b]pyridin-3-yl)propanamide?
The IUPAC name of N-([1,2]oxazolo[5,4-b]pyridin-3-yl)propanamide (CID 42110353) is N-([1,2]oxazolo[5,4-b]pyridin-3-yl)propanamide.
What is the SMILES notation for N-([1,2]oxazolo[5,4-b]pyridin-3-yl)propanamide?
The canonical SMILES for N-([1,2]oxazolo[5,4-b]pyridin-3-yl)propanamide is CCC(=O)Nc1noc2ncccc12.
What is the InChIKey of N-([1,2]oxazolo[5,4-b]pyridin-3-yl)propanamide?
The InChIKey is LPKYLYQRZGIMAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3O2/c1-2-7(13)11-8-6-4-3-5-10-9(6)14-12-8/h3-5H,2H2,1H3,(H,11,12,13).
What are the key properties of N-([1,2]oxazolo[5,4-b]pyridin-3-yl)propanamide?
N-([1,2]oxazolo[5,4-b]pyridin-3-yl)propanamide has a molecular weight of 191.19 g/mol, XLogP of 1.57, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-([1,2]oxazolo[5,4-b]pyridin-3-yl)propanamide is sourced from PubChem (CID 42110353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).