7-cyclobutyloxy-N-[1-[(1R,2S)-2-fluorocyclopropyl]-2-oxo-3-pyridinyl]-2-(1-methyl-2-oxabicyclo[2.1.1]hexan-4-yl)imidazo[1,2-a]pyridine-6-carboxamide

C26H27FN4O4 — CID 164555072

IUPAC7-cyclobutyloxy-N-[1-[(1R,2S)-2-fluorocyclopropyl]-2-oxo-3-pyridinyl]-2-(1-methyl-2-oxabicyclo[2.1.1]hexan-4-yl)imidazo[1,2-a]pyridine-6-carboxamide
SMILESCC12CC(c3cn4cc(C(=O)Nc5cccn([C@@H]6C[C@@H]6F)c5=O)c(OC5CCC5)cc4n3)(CO1)C2
InChIInChI=1S/C26H27FN4O4/c1-25-12-26(13-25,14-34-25)21-11-30-10-16(20(9-22(30)29-21)35-15-4-2-5-15)23(32)28-18-6-3-7-31(24(18)33)19-8-17(19)27/h3,6-7,9-11,15,17,19H,2,4-5,8,12-14H2,1H3,(H,28,32)/t17-,19+,25?,26?/m0/s1
InChIKeyAPCNFGAKLADMNQ-JXHSZPPQSA-N
MW478.52 g/mol
LogP3.78
Rot. Bonds6

About 7-cyclobutyloxy-N-[1-[(1R,2S)-2-fluorocyclopropyl]-2-oxo-3-pyridinyl]-2-(1-methyl-2-oxabicyclo[2.1.1]hexan-4-yl)imidazo[1,2-a]pyridine-6-carboxamide

7-cyclobutyloxy-N-[1-[(1R,2S)-2-fluorocyclopropyl]-2-oxo-3-pyridinyl]-2-(1-methyl-2-oxabicyclo[2.1.1]hexan-4-yl)imidazo[1,2-a]pyridine-6-carboxamide (PubChem CID 164555072) has the molecular formula C26H27FN4O4 and a molecular weight of 478.52 g/mol. Its IUPAC name is 7-cyclobutyloxy-N-[1-[(1R,2S)-2-fluorocyclopropyl]-2-oxo-3-pyridinyl]-2-(1-methyl-2-oxabicyclo[2.1.1]hexan-4-yl)imidazo[1,2-a]pyridine-6-carboxamide.

Molecular Properties

Compound Name7-cyclobutyloxy-N-[1-[(1R,2S)-2-fluorocyclopropyl]-2-oxo-3-pyridinyl]-2-(1-methyl-2-oxabicyclo[2.1.1]hexan-4-yl)imidazo[1,2-a]pyridine-6-carboxamide
PubChem CID164555072
Molecular FormulaC26H27FN4O4
Molecular Weight478.52 g/mol
Exact Mass478.20
IUPAC Name7-cyclobutyloxy-N-[1-[(1R,2S)-2-fluorocyclopropyl]-2-oxo-3-pyridinyl]-2-(1-methyl-2-oxabicyclo[2.1.1]hexan-4-yl)imidazo[1,2-a]pyridine-6-carboxamide
SMILESCC12CC(c3cn4cc(C(=O)Nc5cccn([C@@H]6C[C@@H]6F)c5=O)c(OC5CCC5)cc4n3)(CO1)C2
InChIInChI=1S/C26H27FN4O4/c1-25-12-26(13-25,14-34-25)21-11-30-10-16(20(9-22(30)29-21)35-15-4-2-5-15)23(32)28-18-6-3-7-31(24(18)33)19-8-17(19)27/h3,6-7,9-11,15,17,19H,2,4-5,8,12-14H2,1H3,(H,28,32)/t17-,19+,25?,26?/m0/s1
InChIKeyAPCNFGAKLADMNQ-JXHSZPPQSA-N
XLogP3.78
TPSA86.86 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms35
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500478.52
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 7-cyclobutyloxy-N-[1-[(1R,2S)-2-fluorocyclopropyl]-2-oxo-3-pyridinyl]-2-(1-methyl-2-oxabicyclo[2.1.1]hexan-4-yl)imidazo[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 7-cyclobutyloxy-N-[1-[(1R,2S)-2-fluorocyclopropyl]-2-oxo-3-pyridinyl]-2-(1-methyl-2-oxabicyclo[2.1.1]hexan-4-yl)imidazo[1,2-a]pyridine-6-carboxamide?
The IUPAC name of 7-cyclobutyloxy-N-[1-[(1R,2S)-2-fluorocyclopropyl]-2-oxo-3-pyridinyl]-2-(1-methyl-2-oxabicyclo[2.1.1]hexan-4-yl)imidazo[1,2-a]pyridine-6-carboxamide (CID 164555072) is 7-cyclobutyloxy-N-[1-[(1R,2S)-2-fluorocyclopropyl]-2-oxo-3-pyridinyl]-2-(1-methyl-2-oxabicyclo[2.1.1]hexan-4-yl)imidazo[1,2-a]pyridine-6-carboxamide.
What is the SMILES notation for 7-cyclobutyloxy-N-[1-[(1R,2S)-2-fluorocyclopropyl]-2-oxo-3-pyridinyl]-2-(1-methyl-2-oxabicyclo[2.1.1]hexan-4-yl)imidazo[1,2-a]pyridine-6-carboxamide?
The canonical SMILES for 7-cyclobutyloxy-N-[1-[(1R,2S)-2-fluorocyclopropyl]-2-oxo-3-pyridinyl]-2-(1-methyl-2-oxabicyclo[2.1.1]hexan-4-yl)imidazo[1,2-a]pyridine-6-carboxamide is CC12CC(c3cn4cc(C(=O)Nc5cccn([C@@H]6C[C@@H]6F)c5=O)c(OC5CCC5)cc4n3)(CO1)C2.
What is the InChIKey of 7-cyclobutyloxy-N-[1-[(1R,2S)-2-fluorocyclopropyl]-2-oxo-3-pyridinyl]-2-(1-methyl-2-oxabicyclo[2.1.1]hexan-4-yl)imidazo[1,2-a]pyridine-6-carboxamide?
The InChIKey is APCNFGAKLADMNQ-JXHSZPPQSA-N. The full InChI is InChI=1S/C26H27FN4O4/c1-25-12-26(13-25,14-34-25)21-11-30-10-16(20(9-22(30)29-21)35-15-4-2-5-15)23(32)28-18-6-3-7-31(24(18)33)19-8-17(19)27/h3,6-7,9-11,15,17,19H,2,4-5,8,12-14H2,1H3,(H,28,32)/t17-,19+,25?,26?/m0/s1.
What are the key properties of 7-cyclobutyloxy-N-[1-[(1R,2S)-2-fluorocyclopropyl]-2-oxo-3-pyridinyl]-2-(1-methyl-2-oxabicyclo[2.1.1]hexan-4-yl)imidazo[1,2-a]pyridine-6-carboxamide?
7-cyclobutyloxy-N-[1-[(1R,2S)-2-fluorocyclopropyl]-2-oxo-3-pyridinyl]-2-(1-methyl-2-oxabicyclo[2.1.1]hexan-4-yl)imidazo[1,2-a]pyridine-6-carboxamide has a molecular weight of 478.52 g/mol, XLogP of 3.78, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 7-cyclobutyloxy-N-[1-[(1R,2S)-2-fluorocyclopropyl]-2-oxo-3-pyridinyl]-2-(1-methyl-2-oxabicyclo[2.1.1]hexan-4-yl)imidazo[1,2-a]pyridine-6-carboxamide is sourced from PubChem (CID 164555072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).