N-ethyl-3-methyl-N-(oxolan-3-ylmethyl)-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide

C15H19N3O3 — CID 53497826

IUPACN-ethyl-3-methyl-N-(oxolan-3-ylmethyl)-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide
SMILESCCN(CC1CCOC1)C(=O)c1cnc2onc(C)c2c1
InChIInChI=1S/C15H19N3O3/c1-3-18(8-11-4-5-20-9-11)15(19)12-6-13-10(2)17-21-14(13)16-7-12/h6-7,11H,3-5,8-9H2,1-2H3
InChIKeyHDGJFRNXVFKFMM-UHFFFAOYSA-N
MW289.33 g/mol
LogP2.03
Rot. Bonds4

About N-ethyl-3-methyl-N-(oxolan-3-ylmethyl)-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide

N-ethyl-3-methyl-N-(oxolan-3-ylmethyl)-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide (PubChem CID 53497826) has the molecular formula C15H19N3O3 and a molecular weight of 289.33 g/mol. Its IUPAC name is N-ethyl-3-methyl-N-(oxolan-3-ylmethyl)-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide.

Molecular Properties

Compound NameN-ethyl-3-methyl-N-(oxolan-3-ylmethyl)-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide
PubChem CID53497826
Molecular FormulaC15H19N3O3
Molecular Weight289.33 g/mol
Exact Mass289.14
IUPAC NameN-ethyl-3-methyl-N-(oxolan-3-ylmethyl)-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide
SMILESCCN(CC1CCOC1)C(=O)c1cnc2onc(C)c2c1
InChIInChI=1S/C15H19N3O3/c1-3-18(8-11-4-5-20-9-11)15(19)12-6-13-10(2)17-21-14(13)16-7-12/h6-7,11H,3-5,8-9H2,1-2H3
InChIKeyHDGJFRNXVFKFMM-UHFFFAOYSA-N
XLogP2.03
TPSA68.46 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.33
LogP ≤ 52.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze N-ethyl-3-methyl-N-(oxolan-3-ylmethyl)-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-methyl-N-(oxolan-3-ylmethyl)-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide?
The IUPAC name of N-ethyl-3-methyl-N-(oxolan-3-ylmethyl)-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide (CID 53497826) is N-ethyl-3-methyl-N-(oxolan-3-ylmethyl)-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide.
What is the SMILES notation for N-ethyl-3-methyl-N-(oxolan-3-ylmethyl)-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide?
The canonical SMILES for N-ethyl-3-methyl-N-(oxolan-3-ylmethyl)-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide is CCN(CC1CCOC1)C(=O)c1cnc2onc(C)c2c1.
What is the InChIKey of N-ethyl-3-methyl-N-(oxolan-3-ylmethyl)-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide?
The InChIKey is HDGJFRNXVFKFMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O3/c1-3-18(8-11-4-5-20-9-11)15(19)12-6-13-10(2)17-21-14(13)16-7-12/h6-7,11H,3-5,8-9H2,1-2H3.
What are the key properties of N-ethyl-3-methyl-N-(oxolan-3-ylmethyl)-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide?
N-ethyl-3-methyl-N-(oxolan-3-ylmethyl)-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide has a molecular weight of 289.33 g/mol, XLogP of 2.03, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-methyl-N-(oxolan-3-ylmethyl)-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide is sourced from PubChem (CID 53497826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).