4-[[2-[2-fluoro-6-methyl-4-(2-methylbutanoyl)phenyl]-7-methylimidazo[1,2-a]pyridin-3-yl]methyl]morpholin-3-one

C25H28FN3O3 — CID 154965024

IUPAC4-[[2-[2-fluoro-6-methyl-4-(2-methylbutanoyl)phenyl]-7-methylimidazo[1,2-a]pyridin-3-yl]methyl]morpholin-3-one
SMILESCCC(C)C(=O)c1cc(C)c(-c2nc3cc(C)ccn3c2CN2CCOCC2=O)c(F)c1
InChIInChI=1S/C25H28FN3O3/c1-5-16(3)25(31)18-11-17(4)23(19(26)12-18)24-20(13-28-8-9-32-14-22(28)30)29-7-6-15(2)10-21(29)27-24/h6-7,10-12,16H,5,8-9,13-14H2,1-4H3
InChIKeyIGRBIBJBLZGSOE-UHFFFAOYSA-N
MW437.52 g/mol
LogP4.34
Rot. Bonds6

About 4-[[2-[2-fluoro-6-methyl-4-(2-methylbutanoyl)phenyl]-7-methylimidazo[1,2-a]pyridin-3-yl]methyl]morpholin-3-one

4-[[2-[2-fluoro-6-methyl-4-(2-methylbutanoyl)phenyl]-7-methylimidazo[1,2-a]pyridin-3-yl]methyl]morpholin-3-one (PubChem CID 154965024) has the molecular formula C25H28FN3O3 and a molecular weight of 437.52 g/mol. Its IUPAC name is 4-[[2-[2-fluoro-6-methyl-4-(2-methylbutanoyl)phenyl]-7-methylimidazo[1,2-a]pyridin-3-yl]methyl]morpholin-3-one.

Molecular Properties

Compound Name4-[[2-[2-fluoro-6-methyl-4-(2-methylbutanoyl)phenyl]-7-methylimidazo[1,2-a]pyridin-3-yl]methyl]morpholin-3-one
PubChem CID154965024
Molecular FormulaC25H28FN3O3
Molecular Weight437.52 g/mol
Exact Mass437.21
IUPAC Name4-[[2-[2-fluoro-6-methyl-4-(2-methylbutanoyl)phenyl]-7-methylimidazo[1,2-a]pyridin-3-yl]methyl]morpholin-3-one
SMILESCCC(C)C(=O)c1cc(C)c(-c2nc3cc(C)ccn3c2CN2CCOCC2=O)c(F)c1
InChIInChI=1S/C25H28FN3O3/c1-5-16(3)25(31)18-11-17(4)23(19(26)12-18)24-20(13-28-8-9-32-14-22(28)30)29-7-6-15(2)10-21(29)27-24/h6-7,10-12,16H,5,8-9,13-14H2,1-4H3
InChIKeyIGRBIBJBLZGSOE-UHFFFAOYSA-N
XLogP4.34
TPSA63.91 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500437.52
LogP ≤ 54.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 4-[[2-[2-fluoro-6-methyl-4-(2-methylbutanoyl)phenyl]-7-methylimidazo[1,2-a]pyridin-3-yl]methyl]morpholin-3-one with MolForge

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

Launch Full Analysis

Related Compounds

ethane;methyl N-(2,2-dimethoxyethyl)-N-[3-[2-[2-fluoro-6-methyl-4-(2-methylbutanoyl)phenyl]-7-methylimidazo[1,2-a]pyridin-3-yl]-2-hydroxypropyl]carbamate
CID 177064255
1-[3-fluoro-5-methyl-4-[7-methyl-3-(morpholin-2-ylmethyl)imidazo[1,2-a]pyridin-2-yl]phenyl]ethanone
CID 177064297
3,5-difluoro-N-methyl-4-[7-methyl-3-[(4-methylmorpholin-2-yl)methyl]imidazo[1,2-a]pyridin-2-yl]benzamide
CID 166714396
(3S)-3-[[2-[2,6-difluoro-4-(methylcarbamoyl)phenyl]-7-methylimidazo[1,2-a]pyridin-3-yl]methyl]-4-fluoropiperidine-1-carboxylic acid
CID 175171398
methyl 2-[[2-(2,6-difluoro-4-methoxycarbonylphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]methyl]-1,4-oxazepane-4-carboxylate
CID 169277646
ethane;1-[2-(2-fluoro-6-methyl-4-prop-2-ynoylphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]pentan-2-one;methane;molecular hydrogen
CID 177064339
1-[2-(4-bromo-2-fluoro-6-methylphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]-3-chloropropan-2-one
CID 177064451
methyl (2R)-2-[[2-[2,6-difluoro-4-(methylcarbamoyl)phenyl]-7-methylimidazo[1,2-a]pyridin-3-yl]methyl]-1,4-oxazepane-4-carboxylate
CID 156827721
ethane;methyl N-[3-[2-(4-butanoyl-2-fluoro-6-methylphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]-2-oxopropyl]-N-(2,2-dimethoxyethyl)carbamate
CID 177064251
methyl N-[(2S)-3-[2-(4-butanoyl-2-fluoro-6-methylphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]-2-hydroxypropyl]-N-(2,2-dimethoxyethyl)carbamate
CID 177064295
methyl (2S)-2-[[2-[2,6-difluoro-4-(propan-2-ylamino)phenyl]-7-methylimidazo[1,2-a]pyridin-3-yl]methyl]morpholine-4-carboxylate
CID 166774868
2-[[2-[2,6-difluoro-4-(methoxycarbamoyl)phenyl]-7-methylimidazo[1,2-a]pyridin-3-yl]methyl]morpholine-4-carboxylic acid
CID 175167830

Frequently Asked Questions

What is the IUPAC name of 4-[[2-[2-fluoro-6-methyl-4-(2-methylbutanoyl)phenyl]-7-methylimidazo[1,2-a]pyridin-3-yl]methyl]morpholin-3-one?
The IUPAC name of 4-[[2-[2-fluoro-6-methyl-4-(2-methylbutanoyl)phenyl]-7-methylimidazo[1,2-a]pyridin-3-yl]methyl]morpholin-3-one (CID 154965024) is 4-[[2-[2-fluoro-6-methyl-4-(2-methylbutanoyl)phenyl]-7-methylimidazo[1,2-a]pyridin-3-yl]methyl]morpholin-3-one.
What is the SMILES notation for 4-[[2-[2-fluoro-6-methyl-4-(2-methylbutanoyl)phenyl]-7-methylimidazo[1,2-a]pyridin-3-yl]methyl]morpholin-3-one?
The canonical SMILES for 4-[[2-[2-fluoro-6-methyl-4-(2-methylbutanoyl)phenyl]-7-methylimidazo[1,2-a]pyridin-3-yl]methyl]morpholin-3-one is CCC(C)C(=O)c1cc(C)c(-c2nc3cc(C)ccn3c2CN2CCOCC2=O)c(F)c1.
What is the InChIKey of 4-[[2-[2-fluoro-6-methyl-4-(2-methylbutanoyl)phenyl]-7-methylimidazo[1,2-a]pyridin-3-yl]methyl]morpholin-3-one?
The InChIKey is IGRBIBJBLZGSOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H28FN3O3/c1-5-16(3)25(31)18-11-17(4)23(19(26)12-18)24-20(13-28-8-9-32-14-22(28)30)29-7-6-15(2)10-21(29)27-24/h6-7,10-12,16H,5,8-9,13-14H2,1-4H3.
What are the key properties of 4-[[2-[2-fluoro-6-methyl-4-(2-methylbutanoyl)phenyl]-7-methylimidazo[1,2-a]pyridin-3-yl]methyl]morpholin-3-one?
4-[[2-[2-fluoro-6-methyl-4-(2-methylbutanoyl)phenyl]-7-methylimidazo[1,2-a]pyridin-3-yl]methyl]morpholin-3-one has a molecular weight of 437.52 g/mol, XLogP of 4.34, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[2-[2-fluoro-6-methyl-4-(2-methylbutanoyl)phenyl]-7-methylimidazo[1,2-a]pyridin-3-yl]methyl]morpholin-3-one is sourced from PubChem (CID 154965024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).