2-naphthalen-1-yl-[1,3]oxazolo[4,5-b]pyridine

C16H10N2O — CID 666785

IUPAC2-naphthalen-1-yl-[1,3]oxazolo[4,5-b]pyridine
SMILESc1ccc2c(-c3nc4ncccc4o3)cccc2c1
InChIInChI=1S/C16H10N2O/c1-2-7-12-11(5-1)6-3-8-13(12)16-18-15-14(19-16)9-4-10-17-15/h1-10H
InChIKeyDEEXYORJAHHXIN-UHFFFAOYSA-N
MW246.27 g/mol
LogP4.04
Rot. Bonds1

About 2-naphthalen-1-yl-[1,3]oxazolo[4,5-b]pyridine

2-naphthalen-1-yl-[1,3]oxazolo[4,5-b]pyridine (PubChem CID 666785) has the molecular formula C16H10N2O and a molecular weight of 246.27 g/mol. Its IUPAC name is 2-naphthalen-1-yl-[1,3]oxazolo[4,5-b]pyridine.

Molecular Properties

Compound Name2-naphthalen-1-yl-[1,3]oxazolo[4,5-b]pyridine
PubChem CID666785
Molecular FormulaC16H10N2O
Molecular Weight246.27 g/mol
Exact Mass246.08
IUPAC Name2-naphthalen-1-yl-[1,3]oxazolo[4,5-b]pyridine
SMILESc1ccc2c(-c3nc4ncccc4o3)cccc2c1
InChIInChI=1S/C16H10N2O/c1-2-7-12-11(5-1)6-3-8-13(12)16-18-15-14(19-16)9-4-10-17-15/h1-10H
InChIKeyDEEXYORJAHHXIN-UHFFFAOYSA-N
XLogP4.04
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.27
LogP ≤ 54.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-(Oxazolo[4,5-b]pyridin-2-yl)aniline
CID 486277
1-Oxazolo(4,5-b)pyridin-2-yl-6-phenyl-1-hexanone
CID 10085812
1-Heptanone, 1-oxazolo[4,5-b]pyridin-2-yl-7-phenyl-
CID 11150976
3-[4-(Benzyloxy)phenyl]-1-{pyrido[2,3-d][1,3]oxazol-2-yl}propan-1-one
CID 16736010
1-[6-(4-Methylphenyl)-[1,3]oxazolo[4,5-b]pyridin-2-yl]-6-phenylhexan-1-one
CID 122390213
3-(Oxazolo[4,5-b]pyridin-2-yl)aniline
CID 611086
2-methyl-N-[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]propanamide
CID 694846
Oxazolo(4,5-b)pyridine, 2-(2-fluorophenyl)-
CID 1971814
6-[3-([1,3]oxazolo[4,5-B]pyridin-2-Yl)-2-(Trifluoromethyl)phenoxy]-1-(2,4,6-Trifluorobenzyl)quinazolin-4(1h)-One
CID 58439216
1-Oxazolo[4,5-B]pyridin-2-YL-1-dodecanone
CID 9972176
1-Oxazolo(4,5-b)pyridin-2-yl-octadec-9-yn-1-one
CID 9977214
1-[1,3]Oxazolo[4,5-b]pyridin-2-yloctan-1-one
CID 22486174

Frequently Asked Questions

What is the IUPAC name of 2-naphthalen-1-yl-[1,3]oxazolo[4,5-b]pyridine?
The IUPAC name of 2-naphthalen-1-yl-[1,3]oxazolo[4,5-b]pyridine (CID 666785) is 2-naphthalen-1-yl-[1,3]oxazolo[4,5-b]pyridine.
What is the SMILES notation for 2-naphthalen-1-yl-[1,3]oxazolo[4,5-b]pyridine?
The canonical SMILES for 2-naphthalen-1-yl-[1,3]oxazolo[4,5-b]pyridine is c1ccc2c(-c3nc4ncccc4o3)cccc2c1.
What is the InChIKey of 2-naphthalen-1-yl-[1,3]oxazolo[4,5-b]pyridine?
The InChIKey is DEEXYORJAHHXIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10N2O/c1-2-7-12-11(5-1)6-3-8-13(12)16-18-15-14(19-16)9-4-10-17-15/h1-10H.
What are the key properties of 2-naphthalen-1-yl-[1,3]oxazolo[4,5-b]pyridine?
2-naphthalen-1-yl-[1,3]oxazolo[4,5-b]pyridine has a molecular weight of 246.27 g/mol, XLogP of 4.04, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-naphthalen-1-yl-[1,3]oxazolo[4,5-b]pyridine is sourced from PubChem (CID 666785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).