N-(1-cyclopropyl-2-oxo-3-pyridinyl)-2-[1-(fluoromethyl)-2-oxabicyclo[2.1.1]hexan-4-yl]-7-propan-2-yloxyimidazo[1,2-a]pyridine-6-carboxamide

C25H27FN4O4 — CID 164554811

IUPACN-(1-cyclopropyl-2-oxo-3-pyridinyl)-2-[1-(fluoromethyl)-2-oxabicyclo[2.1.1]hexan-4-yl]-7-propan-2-yloxyimidazo[1,2-a]pyridine-6-carboxamide
SMILESCC(C)Oc1cc2nc(C34COC(CF)(C3)C4)cn2cc1C(=O)Nc1cccn(C2CC2)c1=O
InChIInChI=1S/C25H27FN4O4/c1-15(2)34-19-8-21-28-20(24-11-25(12-24,13-26)33-14-24)10-29(21)9-17(19)22(31)27-18-4-3-7-30(23(18)32)16-5-6-16/h3-4,7-10,15-16H,5-6,11-14H2,1-2H3,(H,27,31)
InChIKeyXGMRZGVTKBXRGQ-UHFFFAOYSA-N
MW466.51 g/mol
LogP3.64
Rot. Bonds7

About N-(1-cyclopropyl-2-oxo-3-pyridinyl)-2-[1-(fluoromethyl)-2-oxabicyclo[2.1.1]hexan-4-yl]-7-propan-2-yloxyimidazo[1,2-a]pyridine-6-carboxamide

N-(1-cyclopropyl-2-oxo-3-pyridinyl)-2-[1-(fluoromethyl)-2-oxabicyclo[2.1.1]hexan-4-yl]-7-propan-2-yloxyimidazo[1,2-a]pyridine-6-carboxamide (PubChem CID 164554811) has the molecular formula C25H27FN4O4 and a molecular weight of 466.51 g/mol. Its IUPAC name is N-(1-cyclopropyl-2-oxo-3-pyridinyl)-2-[1-(fluoromethyl)-2-oxabicyclo[2.1.1]hexan-4-yl]-7-propan-2-yloxyimidazo[1,2-a]pyridine-6-carboxamide.

Molecular Properties

Compound NameN-(1-cyclopropyl-2-oxo-3-pyridinyl)-2-[1-(fluoromethyl)-2-oxabicyclo[2.1.1]hexan-4-yl]-7-propan-2-yloxyimidazo[1,2-a]pyridine-6-carboxamide
PubChem CID164554811
Molecular FormulaC25H27FN4O4
Molecular Weight466.51 g/mol
Exact Mass466.20
IUPAC NameN-(1-cyclopropyl-2-oxo-3-pyridinyl)-2-[1-(fluoromethyl)-2-oxabicyclo[2.1.1]hexan-4-yl]-7-propan-2-yloxyimidazo[1,2-a]pyridine-6-carboxamide
SMILESCC(C)Oc1cc2nc(C34COC(CF)(C3)C4)cn2cc1C(=O)Nc1cccn(C2CC2)c1=O
InChIInChI=1S/C25H27FN4O4/c1-15(2)34-19-8-21-28-20(24-11-25(12-24,13-26)33-14-24)10-29(21)9-17(19)22(31)27-18-4-3-7-30(23(18)32)16-5-6-16/h3-4,7-10,15-16H,5-6,11-14H2,1-2H3,(H,27,31)
InChIKeyXGMRZGVTKBXRGQ-UHFFFAOYSA-N
XLogP3.64
TPSA86.86 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500466.51
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze N-(1-cyclopropyl-2-oxo-3-pyridinyl)-2-[1-(fluoromethyl)-2-oxabicyclo[2.1.1]hexan-4-yl]-7-propan-2-yloxyimidazo[1,2-a]pyridine-6-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-(1-cyclopropyl-2-oxo-3-pyridinyl)-2-[1-(fluoromethyl)-2-oxabicyclo[2.1.1]hexan-4-yl]-7-propan-2-yloxyimidazo[1,2-a]pyridine-6-carboxamide?
The IUPAC name of N-(1-cyclopropyl-2-oxo-3-pyridinyl)-2-[1-(fluoromethyl)-2-oxabicyclo[2.1.1]hexan-4-yl]-7-propan-2-yloxyimidazo[1,2-a]pyridine-6-carboxamide (CID 164554811) is N-(1-cyclopropyl-2-oxo-3-pyridinyl)-2-[1-(fluoromethyl)-2-oxabicyclo[2.1.1]hexan-4-yl]-7-propan-2-yloxyimidazo[1,2-a]pyridine-6-carboxamide.
What is the SMILES notation for N-(1-cyclopropyl-2-oxo-3-pyridinyl)-2-[1-(fluoromethyl)-2-oxabicyclo[2.1.1]hexan-4-yl]-7-propan-2-yloxyimidazo[1,2-a]pyridine-6-carboxamide?
The canonical SMILES for N-(1-cyclopropyl-2-oxo-3-pyridinyl)-2-[1-(fluoromethyl)-2-oxabicyclo[2.1.1]hexan-4-yl]-7-propan-2-yloxyimidazo[1,2-a]pyridine-6-carboxamide is CC(C)Oc1cc2nc(C34COC(CF)(C3)C4)cn2cc1C(=O)Nc1cccn(C2CC2)c1=O.
What is the InChIKey of N-(1-cyclopropyl-2-oxo-3-pyridinyl)-2-[1-(fluoromethyl)-2-oxabicyclo[2.1.1]hexan-4-yl]-7-propan-2-yloxyimidazo[1,2-a]pyridine-6-carboxamide?
The InChIKey is XGMRZGVTKBXRGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H27FN4O4/c1-15(2)34-19-8-21-28-20(24-11-25(12-24,13-26)33-14-24)10-29(21)9-17(19)22(31)27-18-4-3-7-30(23(18)32)16-5-6-16/h3-4,7-10,15-16H,5-6,11-14H2,1-2H3,(H,27,31).
What are the key properties of N-(1-cyclopropyl-2-oxo-3-pyridinyl)-2-[1-(fluoromethyl)-2-oxabicyclo[2.1.1]hexan-4-yl]-7-propan-2-yloxyimidazo[1,2-a]pyridine-6-carboxamide?
N-(1-cyclopropyl-2-oxo-3-pyridinyl)-2-[1-(fluoromethyl)-2-oxabicyclo[2.1.1]hexan-4-yl]-7-propan-2-yloxyimidazo[1,2-a]pyridine-6-carboxamide has a molecular weight of 466.51 g/mol, XLogP of 3.64, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropyl-2-oxo-3-pyridinyl)-2-[1-(fluoromethyl)-2-oxabicyclo[2.1.1]hexan-4-yl]-7-propan-2-yloxyimidazo[1,2-a]pyridine-6-carboxamide is sourced from PubChem (CID 164554811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).