6-cyclopropyl-3-methyl-N-(1-propylpiperidin-4-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide

C19H26N4O2 — CID 86916614

IUPAC6-cyclopropyl-3-methyl-N-(1-propylpiperidin-4-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
SMILESCCCN1CCC(NC(=O)c2cc(C3CC3)nc3onc(C)c23)CC1
InChIInChI=1S/C19H26N4O2/c1-3-8-23-9-6-14(7-10-23)20-18(24)15-11-16(13-4-5-13)21-19-17(15)12(2)22-25-19/h11,13-14H,3-10H2,1-2H3,(H,20,24)
InChIKeyWGAVBSUDPMIRQI-UHFFFAOYSA-N
MW342.44 g/mol
LogP3.01
Rot. Bonds5

About 6-cyclopropyl-3-methyl-N-(1-propylpiperidin-4-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide

6-cyclopropyl-3-methyl-N-(1-propylpiperidin-4-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide (PubChem CID 86916614) has the molecular formula C19H26N4O2 and a molecular weight of 342.44 g/mol. Its IUPAC name is 6-cyclopropyl-3-methyl-N-(1-propylpiperidin-4-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide.

Molecular Properties

Compound Name6-cyclopropyl-3-methyl-N-(1-propylpiperidin-4-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
PubChem CID86916614
Molecular FormulaC19H26N4O2
Molecular Weight342.44 g/mol
Exact Mass342.21
IUPAC Name6-cyclopropyl-3-methyl-N-(1-propylpiperidin-4-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
SMILESCCCN1CCC(NC(=O)c2cc(C3CC3)nc3onc(C)c23)CC1
InChIInChI=1S/C19H26N4O2/c1-3-8-23-9-6-14(7-10-23)20-18(24)15-11-16(13-4-5-13)21-19-17(15)12(2)22-25-19/h11,13-14H,3-10H2,1-2H3,(H,20,24)
InChIKeyWGAVBSUDPMIRQI-UHFFFAOYSA-N
XLogP3.01
TPSA71.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.44
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-3-methyl-N-(1-propylpiperidin-4-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide?
The IUPAC name of 6-cyclopropyl-3-methyl-N-(1-propylpiperidin-4-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide (CID 86916614) is 6-cyclopropyl-3-methyl-N-(1-propylpiperidin-4-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide.
What is the SMILES notation for 6-cyclopropyl-3-methyl-N-(1-propylpiperidin-4-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide?
The canonical SMILES for 6-cyclopropyl-3-methyl-N-(1-propylpiperidin-4-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide is CCCN1CCC(NC(=O)c2cc(C3CC3)nc3onc(C)c23)CC1.
What is the InChIKey of 6-cyclopropyl-3-methyl-N-(1-propylpiperidin-4-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide?
The InChIKey is WGAVBSUDPMIRQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N4O2/c1-3-8-23-9-6-14(7-10-23)20-18(24)15-11-16(13-4-5-13)21-19-17(15)12(2)22-25-19/h11,13-14H,3-10H2,1-2H3,(H,20,24).
What are the key properties of 6-cyclopropyl-3-methyl-N-(1-propylpiperidin-4-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide?
6-cyclopropyl-3-methyl-N-(1-propylpiperidin-4-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide has a molecular weight of 342.44 g/mol, XLogP of 3.01, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-3-methyl-N-(1-propylpiperidin-4-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide is sourced from PubChem (CID 86916614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).