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

C18H19N3O2 — CID 2284890

IUPACN-[2-methyl-5-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]pentanamide
SMILESCCCCC(=O)Nc1cc(-c2nc3ncccc3o2)ccc1C
InChIInChI=1S/C18H19N3O2/c1-3-4-7-16(22)20-14-11-13(9-8-12(14)2)18-21-17-15(23-18)6-5-10-19-17/h5-6,8-11H,3-4,7H2,1-2H3,(H,20,22)
InChIKeyLLBWHYLENVJWQX-UHFFFAOYSA-N
MW309.37 g/mol
LogP4.33
Rot. Bonds5

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

N-[2-methyl-5-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]pentanamide (PubChem CID 2284890) has the molecular formula C18H19N3O2 and a molecular weight of 309.37 g/mol. Its IUPAC name is N-[2-methyl-5-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]pentanamide.

Molecular Properties

Compound NameN-[2-methyl-5-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]pentanamide
PubChem CID2284890
Molecular FormulaC18H19N3O2
Molecular Weight309.37 g/mol
Exact Mass309.15
IUPAC NameN-[2-methyl-5-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]pentanamide
SMILESCCCCC(=O)Nc1cc(-c2nc3ncccc3o2)ccc1C
InChIInChI=1S/C18H19N3O2/c1-3-4-7-16(22)20-14-11-13(9-8-12(14)2)18-21-17-15(23-18)6-5-10-19-17/h5-6,8-11H,3-4,7H2,1-2H3,(H,20,22)
InChIKeyLLBWHYLENVJWQX-UHFFFAOYSA-N
XLogP4.33
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.37
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-methyl-5-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]pentanamide?
The IUPAC name of N-[2-methyl-5-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]pentanamide (CID 2284890) is N-[2-methyl-5-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]pentanamide.
What is the SMILES notation for N-[2-methyl-5-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]pentanamide?
The canonical SMILES for N-[2-methyl-5-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]pentanamide is CCCCC(=O)Nc1cc(-c2nc3ncccc3o2)ccc1C.
What is the InChIKey of N-[2-methyl-5-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]pentanamide?
The InChIKey is LLBWHYLENVJWQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O2/c1-3-4-7-16(22)20-14-11-13(9-8-12(14)2)18-21-17-15(23-18)6-5-10-19-17/h5-6,8-11H,3-4,7H2,1-2H3,(H,20,22).
What are the key properties of N-[2-methyl-5-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]pentanamide?
N-[2-methyl-5-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]pentanamide has a molecular weight of 309.37 g/mol, XLogP of 4.33, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methyl-5-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]pentanamide is sourced from PubChem (CID 2284890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).