N-cyclohexyl-3-oxo-4,5,6,7-tetrahydro-[1,2]oxazolo[5,4-c]pyridine-2-carboxamide

C13H19N3O3 — CID 12851775

IUPACN-cyclohexyl-3-oxo-4,5,6,7-tetrahydro-[1,2]oxazolo[5,4-c]pyridine-2-carboxamide
SMILESO=C(NC1CCCCC1)n1oc2c(c1=O)CCNC2
InChIInChI=1S/C13H19N3O3/c17-12-10-6-7-14-8-11(10)19-16(12)13(18)15-9-4-2-1-3-5-9/h9,14H,1-8H2,(H,15,18)
InChIKeyZTFQMZOSCVYDCB-UHFFFAOYSA-N
MW265.31 g/mol
LogP0.98
Rot. Bonds1

About N-cyclohexyl-3-oxo-4,5,6,7-tetrahydro-[1,2]oxazolo[5,4-c]pyridine-2-carboxamide

N-cyclohexyl-3-oxo-4,5,6,7-tetrahydro-[1,2]oxazolo[5,4-c]pyridine-2-carboxamide (PubChem CID 12851775) has the molecular formula C13H19N3O3 and a molecular weight of 265.31 g/mol. Its IUPAC name is N-cyclohexyl-3-oxo-4,5,6,7-tetrahydro-[1,2]oxazolo[5,4-c]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-3-oxo-4,5,6,7-tetrahydro-[1,2]oxazolo[5,4-c]pyridine-2-carboxamide
PubChem CID12851775
Molecular FormulaC13H19N3O3
Molecular Weight265.31 g/mol
Exact Mass265.14
IUPAC NameN-cyclohexyl-3-oxo-4,5,6,7-tetrahydro-[1,2]oxazolo[5,4-c]pyridine-2-carboxamide
SMILESO=C(NC1CCCCC1)n1oc2c(c1=O)CCNC2
InChIInChI=1S/C13H19N3O3/c17-12-10-6-7-14-8-11(10)19-16(12)13(18)15-9-4-2-1-3-5-9/h9,14H,1-8H2,(H,15,18)
InChIKeyZTFQMZOSCVYDCB-UHFFFAOYSA-N
XLogP0.98
TPSA76.27 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 50.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-cyclohexyl-3-oxo-4,5,6,7-tetrahydro-[1,2]oxazolo[5,4-c]pyridine-2-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-cyclohexyl-3-oxo-4,5,6,7-tetrahydro-[1,2]oxazolo[5,4-c]pyridine-2-carboxamide?
The IUPAC name of N-cyclohexyl-3-oxo-4,5,6,7-tetrahydro-[1,2]oxazolo[5,4-c]pyridine-2-carboxamide (CID 12851775) is N-cyclohexyl-3-oxo-4,5,6,7-tetrahydro-[1,2]oxazolo[5,4-c]pyridine-2-carboxamide.
What is the SMILES notation for N-cyclohexyl-3-oxo-4,5,6,7-tetrahydro-[1,2]oxazolo[5,4-c]pyridine-2-carboxamide?
The canonical SMILES for N-cyclohexyl-3-oxo-4,5,6,7-tetrahydro-[1,2]oxazolo[5,4-c]pyridine-2-carboxamide is O=C(NC1CCCCC1)n1oc2c(c1=O)CCNC2.
What is the InChIKey of N-cyclohexyl-3-oxo-4,5,6,7-tetrahydro-[1,2]oxazolo[5,4-c]pyridine-2-carboxamide?
The InChIKey is ZTFQMZOSCVYDCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O3/c17-12-10-6-7-14-8-11(10)19-16(12)13(18)15-9-4-2-1-3-5-9/h9,14H,1-8H2,(H,15,18).
What are the key properties of N-cyclohexyl-3-oxo-4,5,6,7-tetrahydro-[1,2]oxazolo[5,4-c]pyridine-2-carboxamide?
N-cyclohexyl-3-oxo-4,5,6,7-tetrahydro-[1,2]oxazolo[5,4-c]pyridine-2-carboxamide has a molecular weight of 265.31 g/mol, XLogP of 0.98, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-3-oxo-4,5,6,7-tetrahydro-[1,2]oxazolo[5,4-c]pyridine-2-carboxamide is sourced from PubChem (CID 12851775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).