N-[4,5-dimethoxy-2-(4-morpholin-4-ylbutanoyl)phenyl]-2-fluorobenzamide;3-fluoro-N-[2-methoxy-6-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-fluoro-N-[2-methoxy-6-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-methoxy-N-[2-methoxy-6-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;N-[2-(4-morpholin-4-ylbutanoyl)phenyl]-3-(trifluoromethyl)benzamide

C112H128F6N10O21 — CID 158534523

IUPACN-[4,5-dimethoxy-2-(4-morpholin-4-ylbutanoyl)phenyl]-2-fluorobenzamide;3-fluoro-N-[2-methoxy-6-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-fluoro-N-[2-methoxy-6-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-methoxy-N-[2-methoxy-6-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;N-[2-(4-morpholin-4-ylbutanoyl)phenyl]-3-(trifluoromethyl)benzamide
SMILESCOc1cc(NC(=O)c2ccccc2F)c(C(=O)CCCN2CCOCC2)cc1OC.COc1ccc(C(=O)Nc2c(OC)cccc2C(=O)CCCN2CCOCC2)cc1.COc1cccc(C(=O)CCCN2CCOCC2)c1NC(=O)c1ccc(F)cc1.COc1cccc(C(=O)CCCN2CCOCC2)c1NC(=O)c1cccc(F)c1.O=C(Nc1ccccc1C(=O)CCCN1CCOCC1)c1cccc(C(F)(F)F)c1
InChIInChI=1S/C23H27FN2O5.C23H28N2O5.C22H23F3N2O3.2C22H25FN2O4/c1-29-21-14-17(20(27)8-5-9-26-10-12-31-13-11-26)19(15-22(21)30-2)25-23(28)16-6-3-4-7-18(16)24;1-28-18-10-8-17(9-11-18)23(27)24-22-19(5-3-7-21(22)29-2)20(26)6-4-12-25-13-15-30-16-14-25;23-22(24,25)17-6-3-5-16(15-17)21(29)26-19-8-2-1-7-18(19)20(28)9-4-10-27-11-13-30-14-12-27;1-28-20-9-3-7-18(19(26)8-4-10-25-11-13-29-14-12-25)21(20)24-22(27)16-5-2-6-17(23)15-16;1-28-20-6-2-4-18(19(26)5-3-11-25-12-14-29-15-13-25)21(20)24-22(27)16-7-9-17(23)10-8-16/h3-4,6-7,14-15H,5,8-13H2,1-2H3,(H,25,28);3,5,7-11H,4,6,12-16H2,1-2H3,(H,24,27);1-3,5-8,15H,4,9-14H2,(H,26,29);2-3,5-7,9,15H,4,8,10-14H2,1H3,(H,24,27);2,4,6-10H,3,5,11-15H2,1H3,(H,24,27)
InChIKeyHNTXRQIGSVOCIR-UHFFFAOYSA-N
MW2064.29 g/mol
LogP17.66
Rot. Bonds41

About N-[4,5-dimethoxy-2-(4-morpholin-4-ylbutanoyl)phenyl]-2-fluorobenzamide;3-fluoro-N-[2-methoxy-6-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-fluoro-N-[2-methoxy-6-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-methoxy-N-[2-methoxy-6-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;N-[2-(4-morpholin-4-ylbutanoyl)phenyl]-3-(trifluoromethyl)benzamide

N-[4,5-dimethoxy-2-(4-morpholin-4-ylbutanoyl)phenyl]-2-fluorobenzamide;3-fluoro-N-[2-methoxy-6-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-fluoro-N-[2-methoxy-6-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-methoxy-N-[2-methoxy-6-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;N-[2-(4-morpholin-4-ylbutanoyl)phenyl]-3-(trifluoromethyl)benzamide (PubChem CID 158534523) has the molecular formula C112H128F6N10O21 and a molecular weight of 2064.29 g/mol. Its IUPAC name is N-[4,5-dimethoxy-2-(4-morpholin-4-ylbutanoyl)phenyl]-2-fluorobenzamide;3-fluoro-N-[2-methoxy-6-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-fluoro-N-[2-methoxy-6-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-methoxy-N-[2-methoxy-6-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;N-[2-(4-morpholin-4-ylbutanoyl)phenyl]-3-(trifluoromethyl)benzamide.

Molecular Properties

Compound NameN-[4,5-dimethoxy-2-(4-morpholin-4-ylbutanoyl)phenyl]-2-fluorobenzamide;3-fluoro-N-[2-methoxy-6-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-fluoro-N-[2-methoxy-6-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-methoxy-N-[2-methoxy-6-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;N-[2-(4-morpholin-4-ylbutanoyl)phenyl]-3-(trifluoromethyl)benzamide
PubChem CID158534523
Molecular FormulaC112H128F6N10O21
Molecular Weight2064.29 g/mol
Exact Mass2062.92
IUPAC NameN-[4,5-dimethoxy-2-(4-morpholin-4-ylbutanoyl)phenyl]-2-fluorobenzamide;3-fluoro-N-[2-methoxy-6-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-fluoro-N-[2-methoxy-6-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-methoxy-N-[2-methoxy-6-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;N-[2-(4-morpholin-4-ylbutanoyl)phenyl]-3-(trifluoromethyl)benzamide
SMILESCOc1cc(NC(=O)c2ccccc2F)c(C(=O)CCCN2CCOCC2)cc1OC.COc1ccc(C(=O)Nc2c(OC)cccc2C(=O)CCCN2CCOCC2)cc1.COc1cccc(C(=O)CCCN2CCOCC2)c1NC(=O)c1ccc(F)cc1.COc1cccc(C(=O)CCCN2CCOCC2)c1NC(=O)c1cccc(F)c1.O=C(Nc1ccccc1C(=O)CCCN1CCOCC1)c1cccc(C(F)(F)F)c1
InChIInChI=1S/C23H27FN2O5.C23H28N2O5.C22H23F3N2O3.2C22H25FN2O4/c1-29-21-14-17(20(27)8-5-9-26-10-12-31-13-11-26)19(15-22(21)30-2)25-23(28)16-6-3-4-7-18(16)24;1-28-18-10-8-17(9-11-18)23(27)24-22-19(5-3-7-21(22)29-2)20(26)6-4-12-25-13-15-30-16-14-25;23-22(24,25)17-6-3-5-16(15-17)21(29)26-19-8-2-1-7-18(19)20(28)9-4-10-27-11-13-30-14-12-27;1-28-20-9-3-7-18(19(26)8-4-10-25-11-13-29-14-12-25)21(20)24-22(27)16-5-2-6-17(23)15-16;1-28-20-6-2-4-18(19(26)5-3-11-25-12-14-29-15-13-25)21(20)24-22(27)16-7-9-17(23)10-8-16/h3-4,6-7,14-15H,5,8-13H2,1-2H3,(H,25,28);3,5,7-11H,4,6,12-16H2,1-2H3,(H,24,27);1-3,5-8,15H,4,9-14H2,(H,26,29);2-3,5-7,9,15H,4,8,10-14H2,1H3,(H,24,27);2,4,6-10H,3,5,11-15H2,1H3,(H,24,27)
InChIKeyHNTXRQIGSVOCIR-UHFFFAOYSA-N
XLogP17.66
TPSA348.58 Ų
H-Bond Donors5
H-Bond Acceptors26
Rotatable Bonds41
Heavy Atoms149
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002064.29
LogP ≤ 517.66
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1026

Analyze N-[4,5-dimethoxy-2-(4-morpholin-4-ylbutanoyl)phenyl]-2-fluorobenzamide;3-fluoro-N-[2-methoxy-6-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-fluoro-N-[2-methoxy-6-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-methoxy-N-[2-methoxy-6-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;N-[2-(4-morpholin-4-ylbutanoyl)phenyl]-3-(trifluoromethyl)benzamide with MolForge

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Related Compounds

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CID 25014689
N-[4,5-dimethoxy-2-(4-morpholin-4-ylbutanoyl)phenyl]-2-fluorobenzamide
CID 152821046
4,19-Ditert-butyl-4,19-diazaheptacyclo[16.12.0.03,16.05,14.06,11.020,29.021,26]triaconta-1,3(16),5(14),6(11),12,17,20(29),21(26),27-nonaene-15,30-dione;5,12-dicyclohexyl-1,4,8,11-tetrakis(trifluoromethyl)quinolino[2,3-b]acridine-7,14-dione;4,28-dimethyl-8,11,14,17,20,32,35,38,41,44-decaoxa-4,28-diazaheptacyclo[25.21.0.03,25.05,23.07,21.029,47.031,45]octatetraconta-1,3(25),5,7(21),22,26,29,31(45),46-nonaene-24,48-dione;4,19-dioctyl-4,19-diazaheptacyclo[16.12.0.03,16.05,14.06,11.020,29.021,26]triaconta-1,3(16),5(14),6(11),12,17,20(29),21(26),27-nonaene-15,30-dione
CID 157713558
N-[4,5-dimethoxy-2-(5-morpholin-4-ylpentanoyl)phenyl]-2-fluorobenzamide
CID 158108859
2-fluoro-N-[2,3,4-trimethoxy-6-(5-phenylpentanoyl)phenyl]benzamide;N-[2-methoxy-6-(4-phenylbutanoyl)phenyl]naphthalene-2-carboxamide;bis(N-[2-methoxy-6-(5-phenylpentanoyl)phenyl]naphthalene-2-carboxamide);N-[2-(4-piperazin-1-ylbutanoyl)phenyl]-4-(trifluoromethyl)benzamide
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N-[4,5-dimethoxy-2-(4-morpholin-4-ylbutanoyl)phenyl]-2-fluorobenzamide;3-fluoro-N-[2-methoxy-6-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-fluoro-N-[2-methoxy-6-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;2-methoxy-N-[2-methoxy-6-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;N-[2-(4-morpholin-4-ylbutanoyl)phenyl]-4-(trifluoromethyl)benzamide
CID 161622218
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Frequently Asked Questions

What is the IUPAC name of N-[4,5-dimethoxy-2-(4-morpholin-4-ylbutanoyl)phenyl]-2-fluorobenzamide;3-fluoro-N-[2-methoxy-6-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-fluoro-N-[2-methoxy-6-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-methoxy-N-[2-methoxy-6-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;N-[2-(4-morpholin-4-ylbutanoyl)phenyl]-3-(trifluoromethyl)benzamide?
The IUPAC name of N-[4,5-dimethoxy-2-(4-morpholin-4-ylbutanoyl)phenyl]-2-fluorobenzamide;3-fluoro-N-[2-methoxy-6-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-fluoro-N-[2-methoxy-6-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-methoxy-N-[2-methoxy-6-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;N-[2-(4-morpholin-4-ylbutanoyl)phenyl]-3-(trifluoromethyl)benzamide (CID 158534523) is N-[4,5-dimethoxy-2-(4-morpholin-4-ylbutanoyl)phenyl]-2-fluorobenzamide;3-fluoro-N-[2-methoxy-6-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-fluoro-N-[2-methoxy-6-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-methoxy-N-[2-methoxy-6-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;N-[2-(4-morpholin-4-ylbutanoyl)phenyl]-3-(trifluoromethyl)benzamide.
What is the SMILES notation for N-[4,5-dimethoxy-2-(4-morpholin-4-ylbutanoyl)phenyl]-2-fluorobenzamide;3-fluoro-N-[2-methoxy-6-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-fluoro-N-[2-methoxy-6-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-methoxy-N-[2-methoxy-6-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;N-[2-(4-morpholin-4-ylbutanoyl)phenyl]-3-(trifluoromethyl)benzamide?
The canonical SMILES for N-[4,5-dimethoxy-2-(4-morpholin-4-ylbutanoyl)phenyl]-2-fluorobenzamide;3-fluoro-N-[2-methoxy-6-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-fluoro-N-[2-methoxy-6-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-methoxy-N-[2-methoxy-6-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;N-[2-(4-morpholin-4-ylbutanoyl)phenyl]-3-(trifluoromethyl)benzamide is COc1cc(NC(=O)c2ccccc2F)c(C(=O)CCCN2CCOCC2)cc1OC.COc1ccc(C(=O)Nc2c(OC)cccc2C(=O)CCCN2CCOCC2)cc1.COc1cccc(C(=O)CCCN2CCOCC2)c1NC(=O)c1ccc(F)cc1.COc1cccc(C(=O)CCCN2CCOCC2)c1NC(=O)c1cccc(F)c1.O=C(Nc1ccccc1C(=O)CCCN1CCOCC1)c1cccc(C(F)(F)F)c1.
What is the InChIKey of N-[4,5-dimethoxy-2-(4-morpholin-4-ylbutanoyl)phenyl]-2-fluorobenzamide;3-fluoro-N-[2-methoxy-6-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-fluoro-N-[2-methoxy-6-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-methoxy-N-[2-methoxy-6-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;N-[2-(4-morpholin-4-ylbutanoyl)phenyl]-3-(trifluoromethyl)benzamide?
The InChIKey is HNTXRQIGSVOCIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H27FN2O5.C23H28N2O5.C22H23F3N2O3.2C22H25FN2O4/c1-29-21-14-17(20(27)8-5-9-26-10-12-31-13-11-26)19(15-22(21)30-2)25-23(28)16-6-3-4-7-18(16)24;1-28-18-10-8-17(9-11-18)23(27)24-22-19(5-3-7-21(22)29-2)20(26)6-4-12-25-13-15-30-16-14-25;23-22(24,25)17-6-3-5-16(15-17)21(29)26-19-8-2-1-7-18(19)20(28)9-4-10-27-11-13-30-14-12-27;1-28-20-9-3-7-18(19(26)8-4-10-25-11-13-29-14-12-25)21(20)24-22(27)16-5-2-6-17(23)15-16;1-28-20-6-2-4-18(19(26)5-3-11-25-12-14-29-15-13-25)21(20)24-22(27)16-7-9-17(23)10-8-16/h3-4,6-7,14-15H,5,8-13H2,1-2H3,(H,25,28);3,5,7-11H,4,6,12-16H2,1-2H3,(H,24,27);1-3,5-8,15H,4,9-14H2,(H,26,29);2-3,5-7,9,15H,4,8,10-14H2,1H3,(H,24,27);2,4,6-10H,3,5,11-15H2,1H3,(H,24,27).
What are the key properties of N-[4,5-dimethoxy-2-(4-morpholin-4-ylbutanoyl)phenyl]-2-fluorobenzamide;3-fluoro-N-[2-methoxy-6-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-fluoro-N-[2-methoxy-6-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-methoxy-N-[2-methoxy-6-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;N-[2-(4-morpholin-4-ylbutanoyl)phenyl]-3-(trifluoromethyl)benzamide?
N-[4,5-dimethoxy-2-(4-morpholin-4-ylbutanoyl)phenyl]-2-fluorobenzamide;3-fluoro-N-[2-methoxy-6-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-fluoro-N-[2-methoxy-6-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-methoxy-N-[2-methoxy-6-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;N-[2-(4-morpholin-4-ylbutanoyl)phenyl]-3-(trifluoromethyl)benzamide has a molecular weight of 2064.29 g/mol, XLogP of 17.66, 41 rotatable bonds, 5 hydrogen bond donors, and 26 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4,5-dimethoxy-2-(4-morpholin-4-ylbutanoyl)phenyl]-2-fluorobenzamide;3-fluoro-N-[2-methoxy-6-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-fluoro-N-[2-methoxy-6-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-methoxy-N-[2-methoxy-6-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;N-[2-(4-morpholin-4-ylbutanoyl)phenyl]-3-(trifluoromethyl)benzamide is sourced from PubChem (CID 158534523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).