4-[3-fluoro-5-(2-methylpropoxy)phenyl]-1-[5-[4-(morpholin-4-ylmethyl)phenyl]-2-pyridinyl]butan-2-one;4-[3-fluoro-5-(2-methylpropoxy)phenyl]-1-[5-(4-piperidin-1-ylphenyl)-2-pyridinyl]butan-2-one;4-(3-fluorophenyl)-1-[5-[4-(morpholin-4-ylmethyl)phenyl]-2-pyridinyl]butan-2-one;4-(3-fluorophenyl)-1-[5-[4-(piperidin-1-ylmethyl)phenyl]-2-pyridinyl]butan-2-one;4-(3-fluorophenyl)-1-[5-(4-piperidin-1-ylphenyl)-2-pyridinyl]butan-2-one

C139H153F5N10O9 — CID 158511578

IUPAC4-[3-fluoro-5-(2-methylpropoxy)phenyl]-1-[5-[4-(morpholin-4-ylmethyl)phenyl]-2-pyridinyl]butan-2-one;4-[3-fluoro-5-(2-methylpropoxy)phenyl]-1-[5-(4-piperidin-1-ylphenyl)-2-pyridinyl]butan-2-one;4-(3-fluorophenyl)-1-[5-[4-(morpholin-4-ylmethyl)phenyl]-2-pyridinyl]butan-2-one;4-(3-fluorophenyl)-1-[5-[4-(piperidin-1-ylmethyl)phenyl]-2-pyridinyl]butan-2-one;4-(3-fluorophenyl)-1-[5-(4-piperidin-1-ylphenyl)-2-pyridinyl]butan-2-one
SMILESCC(C)COc1cc(F)cc(CCC(=O)Cc2ccc(-c3ccc(CN4CCOCC4)cc3)cn2)c1.CC(C)COc1cc(F)cc(CCC(=O)Cc2ccc(-c3ccc(N4CCCCC4)cc3)cn2)c1.O=C(CCc1cccc(F)c1)Cc1ccc(-c2ccc(CN3CCCCC3)cc2)cn1.O=C(CCc1cccc(F)c1)Cc1ccc(-c2ccc(CN3CCOCC3)cc2)cn1.O=C(CCc1cccc(F)c1)Cc1ccc(-c2ccc(N3CCCCC3)cc2)cn1
InChIInChI=1S/C30H35FN2O3.C30H35FN2O2.C27H29FN2O.C26H27FN2O2.C26H27FN2O/c1-22(2)21-36-30-16-24(15-27(31)17-30)5-10-29(34)18-28-9-8-26(19-32-28)25-6-3-23(4-7-25)20-33-11-13-35-14-12-33;1-22(2)21-35-30-17-23(16-26(31)18-30)6-13-29(34)19-27-10-7-25(20-32-27)24-8-11-28(12-9-24)33-14-4-3-5-15-33;28-25-6-4-5-21(17-25)9-14-27(31)18-26-13-12-24(19-29-26)23-10-7-22(8-11-23)20-30-15-2-1-3-16-30;27-24-3-1-2-20(16-24)6-11-26(30)17-25-10-9-23(18-28-25)22-7-4-21(5-8-22)19-29-12-14-31-15-13-29;27-23-6-4-5-20(17-23)7-14-26(30)18-24-11-8-22(19-28-24)21-9-12-25(13-10-21)29-15-2-1-3-16-29/h3-4,6-9,15-17,19,22H,5,10-14,18,20-21H2,1-2H3;7-12,16-18,20,22H,3-6,13-15,19,21H2,1-2H3;4-8,10-13,17,19H,1-3,9,14-16,18,20H2;1-5,7-10,16,18H,6,11-15,17,19H2;4-6,8-13,17,19H,1-3,7,14-16,18H2
InChIKeyHLCWIFPDBOQHFU-UHFFFAOYSA-N
MW2202.80 g/mol
LogP27.86
Rot. Bonds44

About 4-[3-fluoro-5-(2-methylpropoxy)phenyl]-1-[5-[4-(morpholin-4-ylmethyl)phenyl]-2-pyridinyl]butan-2-one;4-[3-fluoro-5-(2-methylpropoxy)phenyl]-1-[5-(4-piperidin-1-ylphenyl)-2-pyridinyl]butan-2-one;4-(3-fluorophenyl)-1-[5-[4-(morpholin-4-ylmethyl)phenyl]-2-pyridinyl]butan-2-one;4-(3-fluorophenyl)-1-[5-[4-(piperidin-1-ylmethyl)phenyl]-2-pyridinyl]butan-2-one;4-(3-fluorophenyl)-1-[5-(4-piperidin-1-ylphenyl)-2-pyridinyl]butan-2-one

4-[3-fluoro-5-(2-methylpropoxy)phenyl]-1-[5-[4-(morpholin-4-ylmethyl)phenyl]-2-pyridinyl]butan-2-one;4-[3-fluoro-5-(2-methylpropoxy)phenyl]-1-[5-(4-piperidin-1-ylphenyl)-2-pyridinyl]butan-2-one;4-(3-fluorophenyl)-1-[5-[4-(morpholin-4-ylmethyl)phenyl]-2-pyridinyl]butan-2-one;4-(3-fluorophenyl)-1-[5-[4-(piperidin-1-ylmethyl)phenyl]-2-pyridinyl]butan-2-one;4-(3-fluorophenyl)-1-[5-(4-piperidin-1-ylphenyl)-2-pyridinyl]butan-2-one (PubChem CID 158511578) has the molecular formula C139H153F5N10O9 and a molecular weight of 2202.80 g/mol. Its IUPAC name is 4-[3-fluoro-5-(2-methylpropoxy)phenyl]-1-[5-[4-(morpholin-4-ylmethyl)phenyl]-2-pyridinyl]butan-2-one;4-[3-fluoro-5-(2-methylpropoxy)phenyl]-1-[5-(4-piperidin-1-ylphenyl)-2-pyridinyl]butan-2-one;4-(3-fluorophenyl)-1-[5-[4-(morpholin-4-ylmethyl)phenyl]-2-pyridinyl]butan-2-one;4-(3-fluorophenyl)-1-[5-[4-(piperidin-1-ylmethyl)phenyl]-2-pyridinyl]butan-2-one;4-(3-fluorophenyl)-1-[5-(4-piperidin-1-ylphenyl)-2-pyridinyl]butan-2-one.

Molecular Properties

Compound Name4-[3-fluoro-5-(2-methylpropoxy)phenyl]-1-[5-[4-(morpholin-4-ylmethyl)phenyl]-2-pyridinyl]butan-2-one;4-[3-fluoro-5-(2-methylpropoxy)phenyl]-1-[5-(4-piperidin-1-ylphenyl)-2-pyridinyl]butan-2-one;4-(3-fluorophenyl)-1-[5-[4-(morpholin-4-ylmethyl)phenyl]-2-pyridinyl]butan-2-one;4-(3-fluorophenyl)-1-[5-[4-(piperidin-1-ylmethyl)phenyl]-2-pyridinyl]butan-2-one;4-(3-fluorophenyl)-1-[5-(4-piperidin-1-ylphenyl)-2-pyridinyl]butan-2-one
PubChem CID158511578
Molecular FormulaC139H153F5N10O9
Molecular Weight2202.80 g/mol
Exact Mass2201.17
IUPAC Name4-[3-fluoro-5-(2-methylpropoxy)phenyl]-1-[5-[4-(morpholin-4-ylmethyl)phenyl]-2-pyridinyl]butan-2-one;4-[3-fluoro-5-(2-methylpropoxy)phenyl]-1-[5-(4-piperidin-1-ylphenyl)-2-pyridinyl]butan-2-one;4-(3-fluorophenyl)-1-[5-[4-(morpholin-4-ylmethyl)phenyl]-2-pyridinyl]butan-2-one;4-(3-fluorophenyl)-1-[5-[4-(piperidin-1-ylmethyl)phenyl]-2-pyridinyl]butan-2-one;4-(3-fluorophenyl)-1-[5-(4-piperidin-1-ylphenyl)-2-pyridinyl]butan-2-one
SMILESCC(C)COc1cc(F)cc(CCC(=O)Cc2ccc(-c3ccc(CN4CCOCC4)cc3)cn2)c1.CC(C)COc1cc(F)cc(CCC(=O)Cc2ccc(-c3ccc(N4CCCCC4)cc3)cn2)c1.O=C(CCc1cccc(F)c1)Cc1ccc(-c2ccc(CN3CCCCC3)cc2)cn1.O=C(CCc1cccc(F)c1)Cc1ccc(-c2ccc(CN3CCOCC3)cc2)cn1.O=C(CCc1cccc(F)c1)Cc1ccc(-c2ccc(N3CCCCC3)cc2)cn1
InChIInChI=1S/C30H35FN2O3.C30H35FN2O2.C27H29FN2O.C26H27FN2O2.C26H27FN2O/c1-22(2)21-36-30-16-24(15-27(31)17-30)5-10-29(34)18-28-9-8-26(19-32-28)25-6-3-23(4-7-25)20-33-11-13-35-14-12-33;1-22(2)21-35-30-17-23(16-26(31)18-30)6-13-29(34)19-27-10-7-25(20-32-27)24-8-11-28(12-9-24)33-14-4-3-5-15-33;28-25-6-4-5-21(17-25)9-14-27(31)18-26-13-12-24(19-29-26)23-10-7-22(8-11-23)20-30-15-2-1-3-16-30;27-24-3-1-2-20(16-24)6-11-26(30)17-25-10-9-23(18-28-25)22-7-4-21(5-8-22)19-29-12-14-31-15-13-29;27-23-6-4-5-20(17-23)7-14-26(30)18-24-11-8-22(19-28-24)21-9-12-25(13-10-21)29-15-2-1-3-16-29/h3-4,6-9,15-17,19,22H,5,10-14,18,20-21H2,1-2H3;7-12,16-18,20,22H,3-6,13-15,19,21H2,1-2H3;4-8,10-13,17,19H,1-3,9,14-16,18,20H2;1-5,7-10,16,18H,6,11-15,17,19H2;4-6,8-13,17,19H,1-3,7,14-16,18H2
InChIKeyHLCWIFPDBOQHFU-UHFFFAOYSA-N
XLogP27.86
TPSA202.92 Ų
H-Bond Donors
H-Bond Acceptors19
Rotatable Bonds44
Heavy Atoms163
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002202.80
LogP ≤ 527.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1019

Analyze 4-[3-fluoro-5-(2-methylpropoxy)phenyl]-1-[5-[4-(morpholin-4-ylmethyl)phenyl]-2-pyridinyl]butan-2-one;4-[3-fluoro-5-(2-methylpropoxy)phenyl]-1-[5-(4-piperidin-1-ylphenyl)-2-pyridinyl]butan-2-one;4-(3-fluorophenyl)-1-[5-[4-(morpholin-4-ylmethyl)phenyl]-2-pyridinyl]butan-2-one;4-(3-fluorophenyl)-1-[5-[4-(piperidin-1-ylmethyl)phenyl]-2-pyridinyl]butan-2-one;4-(3-fluorophenyl)-1-[5-(4-piperidin-1-ylphenyl)-2-pyridinyl]butan-2-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

4-[3-Fluoro-5-(2-methylpropoxy)phenyl]-1-[5-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-2-pyridinyl]butan-2-one
CID 58190125
4-[3-Fluoro-5-(2-methylpropoxy)phenyl]-1-[5-[4-[(1-methylpiperidin-4-yl)methoxy]phenyl]-2-pyridinyl]butan-2-one
CID 58190166
1-[5-(4-Fluorophenyl)-2-pyridinyl]-4-[3-fluoro-5-(2-piperidin-1-ylethoxy)phenyl]butan-2-one
CID 58190168
1-[5-(4-Ethoxyphenyl)-2-pyridinyl]-4-[3-fluoro-5-(2-morpholin-4-ylethoxy)phenyl]butan-2-one
CID 58190180
1-[5-(4-Ethoxyphenyl)-2-pyridinyl]-4-[3-fluoro-5-(2-piperidin-1-ylethoxy)phenyl]butan-2-one
CID 58190187
4-[3-Fluoro-5-(2-methylpropoxy)phenyl]-1-[5-[4-(morpholin-4-ylmethyl)phenyl]-2-pyridinyl]butan-2-one
CID 58190189
4-[3-Fluoro-5-(2-methylpropoxy)phenyl]-1-[5-(4-piperidin-1-ylphenyl)-2-pyridinyl]butan-2-one
CID 58190193
1-[5-(4-Ethoxyphenyl)-2-pyridinyl]-4-[3-fluoro-5-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]butan-2-one
CID 58190209
4-[3-Fluoro-5-(2-methylpropoxy)phenyl]-1-[5-[4-(piperidin-1-ylmethyl)phenyl]-2-pyridinyl]butan-2-one
CID 58190212
1-[5-[4-Ethoxy-2-(morpholin-4-ylmethyl)phenyl]-2-pyridinyl]-4-[3-fluoro-5-(2-methylpropoxy)phenyl]butan-2-one
CID 58190225
4-[3-Fluoro-5-(2-methylpropoxy)phenyl]-1-[5-(4-morpholin-4-ylphenyl)-2-pyridinyl]butan-2-one
CID 58190238
4-[3-Fluoro-5-(3-morpholin-4-ylpropoxy)phenyl]-1-[5-(4-fluorophenyl)-2-pyridinyl]butan-2-one
CID 58190242

Frequently Asked Questions

What is the IUPAC name of 4-[3-fluoro-5-(2-methylpropoxy)phenyl]-1-[5-[4-(morpholin-4-ylmethyl)phenyl]-2-pyridinyl]butan-2-one;4-[3-fluoro-5-(2-methylpropoxy)phenyl]-1-[5-(4-piperidin-1-ylphenyl)-2-pyridinyl]butan-2-one;4-(3-fluorophenyl)-1-[5-[4-(morpholin-4-ylmethyl)phenyl]-2-pyridinyl]butan-2-one;4-(3-fluorophenyl)-1-[5-[4-(piperidin-1-ylmethyl)phenyl]-2-pyridinyl]butan-2-one;4-(3-fluorophenyl)-1-[5-(4-piperidin-1-ylphenyl)-2-pyridinyl]butan-2-one?
The IUPAC name of 4-[3-fluoro-5-(2-methylpropoxy)phenyl]-1-[5-[4-(morpholin-4-ylmethyl)phenyl]-2-pyridinyl]butan-2-one;4-[3-fluoro-5-(2-methylpropoxy)phenyl]-1-[5-(4-piperidin-1-ylphenyl)-2-pyridinyl]butan-2-one;4-(3-fluorophenyl)-1-[5-[4-(morpholin-4-ylmethyl)phenyl]-2-pyridinyl]butan-2-one;4-(3-fluorophenyl)-1-[5-[4-(piperidin-1-ylmethyl)phenyl]-2-pyridinyl]butan-2-one;4-(3-fluorophenyl)-1-[5-(4-piperidin-1-ylphenyl)-2-pyridinyl]butan-2-one (CID 158511578) is 4-[3-fluoro-5-(2-methylpropoxy)phenyl]-1-[5-[4-(morpholin-4-ylmethyl)phenyl]-2-pyridinyl]butan-2-one;4-[3-fluoro-5-(2-methylpropoxy)phenyl]-1-[5-(4-piperidin-1-ylphenyl)-2-pyridinyl]butan-2-one;4-(3-fluorophenyl)-1-[5-[4-(morpholin-4-ylmethyl)phenyl]-2-pyridinyl]butan-2-one;4-(3-fluorophenyl)-1-[5-[4-(piperidin-1-ylmethyl)phenyl]-2-pyridinyl]butan-2-one;4-(3-fluorophenyl)-1-[5-(4-piperidin-1-ylphenyl)-2-pyridinyl]butan-2-one.
What is the SMILES notation for 4-[3-fluoro-5-(2-methylpropoxy)phenyl]-1-[5-[4-(morpholin-4-ylmethyl)phenyl]-2-pyridinyl]butan-2-one;4-[3-fluoro-5-(2-methylpropoxy)phenyl]-1-[5-(4-piperidin-1-ylphenyl)-2-pyridinyl]butan-2-one;4-(3-fluorophenyl)-1-[5-[4-(morpholin-4-ylmethyl)phenyl]-2-pyridinyl]butan-2-one;4-(3-fluorophenyl)-1-[5-[4-(piperidin-1-ylmethyl)phenyl]-2-pyridinyl]butan-2-one;4-(3-fluorophenyl)-1-[5-(4-piperidin-1-ylphenyl)-2-pyridinyl]butan-2-one?
The canonical SMILES for 4-[3-fluoro-5-(2-methylpropoxy)phenyl]-1-[5-[4-(morpholin-4-ylmethyl)phenyl]-2-pyridinyl]butan-2-one;4-[3-fluoro-5-(2-methylpropoxy)phenyl]-1-[5-(4-piperidin-1-ylphenyl)-2-pyridinyl]butan-2-one;4-(3-fluorophenyl)-1-[5-[4-(morpholin-4-ylmethyl)phenyl]-2-pyridinyl]butan-2-one;4-(3-fluorophenyl)-1-[5-[4-(piperidin-1-ylmethyl)phenyl]-2-pyridinyl]butan-2-one;4-(3-fluorophenyl)-1-[5-(4-piperidin-1-ylphenyl)-2-pyridinyl]butan-2-one is CC(C)COc1cc(F)cc(CCC(=O)Cc2ccc(-c3ccc(CN4CCOCC4)cc3)cn2)c1.CC(C)COc1cc(F)cc(CCC(=O)Cc2ccc(-c3ccc(N4CCCCC4)cc3)cn2)c1.O=C(CCc1cccc(F)c1)Cc1ccc(-c2ccc(CN3CCCCC3)cc2)cn1.O=C(CCc1cccc(F)c1)Cc1ccc(-c2ccc(CN3CCOCC3)cc2)cn1.O=C(CCc1cccc(F)c1)Cc1ccc(-c2ccc(N3CCCCC3)cc2)cn1.
What is the InChIKey of 4-[3-fluoro-5-(2-methylpropoxy)phenyl]-1-[5-[4-(morpholin-4-ylmethyl)phenyl]-2-pyridinyl]butan-2-one;4-[3-fluoro-5-(2-methylpropoxy)phenyl]-1-[5-(4-piperidin-1-ylphenyl)-2-pyridinyl]butan-2-one;4-(3-fluorophenyl)-1-[5-[4-(morpholin-4-ylmethyl)phenyl]-2-pyridinyl]butan-2-one;4-(3-fluorophenyl)-1-[5-[4-(piperidin-1-ylmethyl)phenyl]-2-pyridinyl]butan-2-one;4-(3-fluorophenyl)-1-[5-(4-piperidin-1-ylphenyl)-2-pyridinyl]butan-2-one?
The InChIKey is HLCWIFPDBOQHFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H35FN2O3.C30H35FN2O2.C27H29FN2O.C26H27FN2O2.C26H27FN2O/c1-22(2)21-36-30-16-24(15-27(31)17-30)5-10-29(34)18-28-9-8-26(19-32-28)25-6-3-23(4-7-25)20-33-11-13-35-14-12-33;1-22(2)21-35-30-17-23(16-26(31)18-30)6-13-29(34)19-27-10-7-25(20-32-27)24-8-11-28(12-9-24)33-14-4-3-5-15-33;28-25-6-4-5-21(17-25)9-14-27(31)18-26-13-12-24(19-29-26)23-10-7-22(8-11-23)20-30-15-2-1-3-16-30;27-24-3-1-2-20(16-24)6-11-26(30)17-25-10-9-23(18-28-25)22-7-4-21(5-8-22)19-29-12-14-31-15-13-29;27-23-6-4-5-20(17-23)7-14-26(30)18-24-11-8-22(19-28-24)21-9-12-25(13-10-21)29-15-2-1-3-16-29/h3-4,6-9,15-17,19,22H,5,10-14,18,20-21H2,1-2H3;7-12,16-18,20,22H,3-6,13-15,19,21H2,1-2H3;4-8,10-13,17,19H,1-3,9,14-16,18,20H2;1-5,7-10,16,18H,6,11-15,17,19H2;4-6,8-13,17,19H,1-3,7,14-16,18H2.
What are the key properties of 4-[3-fluoro-5-(2-methylpropoxy)phenyl]-1-[5-[4-(morpholin-4-ylmethyl)phenyl]-2-pyridinyl]butan-2-one;4-[3-fluoro-5-(2-methylpropoxy)phenyl]-1-[5-(4-piperidin-1-ylphenyl)-2-pyridinyl]butan-2-one;4-(3-fluorophenyl)-1-[5-[4-(morpholin-4-ylmethyl)phenyl]-2-pyridinyl]butan-2-one;4-(3-fluorophenyl)-1-[5-[4-(piperidin-1-ylmethyl)phenyl]-2-pyridinyl]butan-2-one;4-(3-fluorophenyl)-1-[5-(4-piperidin-1-ylphenyl)-2-pyridinyl]butan-2-one?
4-[3-fluoro-5-(2-methylpropoxy)phenyl]-1-[5-[4-(morpholin-4-ylmethyl)phenyl]-2-pyridinyl]butan-2-one;4-[3-fluoro-5-(2-methylpropoxy)phenyl]-1-[5-(4-piperidin-1-ylphenyl)-2-pyridinyl]butan-2-one;4-(3-fluorophenyl)-1-[5-[4-(morpholin-4-ylmethyl)phenyl]-2-pyridinyl]butan-2-one;4-(3-fluorophenyl)-1-[5-[4-(piperidin-1-ylmethyl)phenyl]-2-pyridinyl]butan-2-one;4-(3-fluorophenyl)-1-[5-(4-piperidin-1-ylphenyl)-2-pyridinyl]butan-2-one has a molecular weight of 2202.80 g/mol, XLogP of 27.86, 44 rotatable bonds, 0 hydrogen bond donors, and 19 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-fluoro-5-(2-methylpropoxy)phenyl]-1-[5-[4-(morpholin-4-ylmethyl)phenyl]-2-pyridinyl]butan-2-one;4-[3-fluoro-5-(2-methylpropoxy)phenyl]-1-[5-(4-piperidin-1-ylphenyl)-2-pyridinyl]butan-2-one;4-(3-fluorophenyl)-1-[5-[4-(morpholin-4-ylmethyl)phenyl]-2-pyridinyl]butan-2-one;4-(3-fluorophenyl)-1-[5-[4-(piperidin-1-ylmethyl)phenyl]-2-pyridinyl]butan-2-one;4-(3-fluorophenyl)-1-[5-(4-piperidin-1-ylphenyl)-2-pyridinyl]butan-2-one is sourced from PubChem (CID 158511578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).