2-fluoro-N-[2-methoxy-6-(4-phenylbutanoyl)phenyl]benzamide;2-fluoro-N-[5-methoxy-2-(4-phenylbutanoyl)phenyl]benzamide;N-[5-fluoro-2-(4-phenylbutanoyl)phenyl]-4-methoxybenzamide;2-methoxy-N-[2-methoxy-6-(4-phenylbutanoyl)phenyl]benzamide;4-methoxy-N-[5-methoxy-2-(4-phenylbutanoyl)phenyl]benzamide

C122H116F3N5O17 — CID 158884223

IUPAC2-fluoro-N-[2-methoxy-6-(4-phenylbutanoyl)phenyl]benzamide;2-fluoro-N-[5-methoxy-2-(4-phenylbutanoyl)phenyl]benzamide;N-[5-fluoro-2-(4-phenylbutanoyl)phenyl]-4-methoxybenzamide;2-methoxy-N-[2-methoxy-6-(4-phenylbutanoyl)phenyl]benzamide;4-methoxy-N-[5-methoxy-2-(4-phenylbutanoyl)phenyl]benzamide
SMILESCOc1ccc(C(=O)CCCc2ccccc2)c(NC(=O)c2ccccc2F)c1.COc1ccc(C(=O)Nc2cc(F)ccc2C(=O)CCCc2ccccc2)cc1.COc1ccc(C(=O)Nc2cc(OC)ccc2C(=O)CCCc2ccccc2)cc1.COc1cccc(C(=O)CCCc2ccccc2)c1NC(=O)c1ccccc1F.COc1ccccc1C(=O)Nc1c(OC)cccc1C(=O)CCCc1ccccc1
InChIInChI=1S/2C25H25NO4.3C24H22FNO3/c1-29-22-16-7-6-13-20(22)25(28)26-24-19(14-9-17-23(24)30-2)21(27)15-8-12-18-10-4-3-5-11-18;1-29-20-13-11-19(12-14-20)25(28)26-23-17-21(30-2)15-16-22(23)24(27)10-6-9-18-7-4-3-5-8-18;1-29-22-16-8-13-19(21(27)15-7-11-17-9-3-2-4-10-17)23(22)26-24(28)18-12-5-6-14-20(18)25;1-29-18-14-15-20(23(27)13-7-10-17-8-3-2-4-9-17)22(16-18)26-24(28)19-11-5-6-12-21(19)25;1-29-20-13-10-18(11-14-20)24(28)26-22-16-19(25)12-15-21(22)23(27)9-5-8-17-6-3-2-4-7-17/h3-7,9-11,13-14,16-17H,8,12,15H2,1-2H3,(H,26,28);3-5,7-8,11-17H,6,9-10H2,1-2H3,(H,26,28);2-6,8-10,12-14,16H,7,11,15H2,1H3,(H,26,28);2-6,8-9,11-12,14-16H,7,10,13H2,1H3,(H,26,28);2-4,6-7,10-16H,5,8-9H2,1H3,(H,26,28)
InChIKeyJDKIOSIEULNWLK-UHFFFAOYSA-N
MW1981.28 g/mol
LogP26.20
Rot. Bonds42

About 2-fluoro-N-[2-methoxy-6-(4-phenylbutanoyl)phenyl]benzamide;2-fluoro-N-[5-methoxy-2-(4-phenylbutanoyl)phenyl]benzamide;N-[5-fluoro-2-(4-phenylbutanoyl)phenyl]-4-methoxybenzamide;2-methoxy-N-[2-methoxy-6-(4-phenylbutanoyl)phenyl]benzamide;4-methoxy-N-[5-methoxy-2-(4-phenylbutanoyl)phenyl]benzamide

2-fluoro-N-[2-methoxy-6-(4-phenylbutanoyl)phenyl]benzamide;2-fluoro-N-[5-methoxy-2-(4-phenylbutanoyl)phenyl]benzamide;N-[5-fluoro-2-(4-phenylbutanoyl)phenyl]-4-methoxybenzamide;2-methoxy-N-[2-methoxy-6-(4-phenylbutanoyl)phenyl]benzamide;4-methoxy-N-[5-methoxy-2-(4-phenylbutanoyl)phenyl]benzamide (PubChem CID 158884223) has the molecular formula C122H116F3N5O17 and a molecular weight of 1981.28 g/mol. Its IUPAC name is 2-fluoro-N-[2-methoxy-6-(4-phenylbutanoyl)phenyl]benzamide;2-fluoro-N-[5-methoxy-2-(4-phenylbutanoyl)phenyl]benzamide;N-[5-fluoro-2-(4-phenylbutanoyl)phenyl]-4-methoxybenzamide;2-methoxy-N-[2-methoxy-6-(4-phenylbutanoyl)phenyl]benzamide;4-methoxy-N-[5-methoxy-2-(4-phenylbutanoyl)phenyl]benzamide.

Molecular Properties

Compound Name2-fluoro-N-[2-methoxy-6-(4-phenylbutanoyl)phenyl]benzamide;2-fluoro-N-[5-methoxy-2-(4-phenylbutanoyl)phenyl]benzamide;N-[5-fluoro-2-(4-phenylbutanoyl)phenyl]-4-methoxybenzamide;2-methoxy-N-[2-methoxy-6-(4-phenylbutanoyl)phenyl]benzamide;4-methoxy-N-[5-methoxy-2-(4-phenylbutanoyl)phenyl]benzamide
PubChem CID158884223
Molecular FormulaC122H116F3N5O17
Molecular Weight1981.28 g/mol
Exact Mass1979.83
IUPAC Name2-fluoro-N-[2-methoxy-6-(4-phenylbutanoyl)phenyl]benzamide;2-fluoro-N-[5-methoxy-2-(4-phenylbutanoyl)phenyl]benzamide;N-[5-fluoro-2-(4-phenylbutanoyl)phenyl]-4-methoxybenzamide;2-methoxy-N-[2-methoxy-6-(4-phenylbutanoyl)phenyl]benzamide;4-methoxy-N-[5-methoxy-2-(4-phenylbutanoyl)phenyl]benzamide
SMILESCOc1ccc(C(=O)CCCc2ccccc2)c(NC(=O)c2ccccc2F)c1.COc1ccc(C(=O)Nc2cc(F)ccc2C(=O)CCCc2ccccc2)cc1.COc1ccc(C(=O)Nc2cc(OC)ccc2C(=O)CCCc2ccccc2)cc1.COc1cccc(C(=O)CCCc2ccccc2)c1NC(=O)c1ccccc1F.COc1ccccc1C(=O)Nc1c(OC)cccc1C(=O)CCCc1ccccc1
InChIInChI=1S/2C25H25NO4.3C24H22FNO3/c1-29-22-16-7-6-13-20(22)25(28)26-24-19(14-9-17-23(24)30-2)21(27)15-8-12-18-10-4-3-5-11-18;1-29-20-13-11-19(12-14-20)25(28)26-23-17-21(30-2)15-16-22(23)24(27)10-6-9-18-7-4-3-5-8-18;1-29-22-16-8-13-19(21(27)15-7-11-17-9-3-2-4-10-17)23(22)26-24(28)18-12-5-6-14-20(18)25;1-29-18-14-15-20(23(27)13-7-10-17-8-3-2-4-9-17)22(16-18)26-24(28)19-11-5-6-12-21(19)25;1-29-20-13-10-18(11-14-20)24(28)26-22-16-19(25)12-15-21(22)23(27)9-5-8-17-6-3-2-4-7-17/h3-7,9-11,13-14,16-17H,8,12,15H2,1-2H3,(H,26,28);3-5,7-8,11-17H,6,9-10H2,1-2H3,(H,26,28);2-6,8-10,12-14,16H,7,11,15H2,1H3,(H,26,28);2-6,8-9,11-12,14-16H,7,10,13H2,1H3,(H,26,28);2-4,6-7,10-16H,5,8-9H2,1H3,(H,26,28)
InChIKeyJDKIOSIEULNWLK-UHFFFAOYSA-N
XLogP26.20
TPSA295.46 Ų
H-Bond Donors5
H-Bond Acceptors17
Rotatable Bonds42
Heavy Atoms147
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001981.28
LogP ≤ 526.20
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1017

Analyze 2-fluoro-N-[2-methoxy-6-(4-phenylbutanoyl)phenyl]benzamide;2-fluoro-N-[5-methoxy-2-(4-phenylbutanoyl)phenyl]benzamide;N-[5-fluoro-2-(4-phenylbutanoyl)phenyl]-4-methoxybenzamide;2-methoxy-N-[2-methoxy-6-(4-phenylbutanoyl)phenyl]benzamide;4-methoxy-N-[5-methoxy-2-(4-phenylbutanoyl)phenyl]benzamide 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

2-fluoro-N-[5-fluoro-2-(4-phenylbutanoyl)phenyl]benzamide
CID 148674370
4-fluoro-2-[(4-methoxybenzoyl)amino]benzoic acid
CID 16785950
3-methoxy-2-[(2-methoxybenzoyl)amino]-N-(2-phenylethyl)benzamide
CID 118913463
2-fluoro-N-[4-[(4-methoxybenzoyl)amino]phenyl]benzamide
CID 1287432
2-fluoro-4-methoxy-N-(3-phenylpropyl)benzamide
CID 17408402
2-[(4-methoxybenzoyl)amino]-N-(2-phenylethyl)benzamide
CID 2193182
1-(2,4-difluorophenyl)-4-phenylbutan-1-one
CID 63084036
2,4-difluoro-N-[4-[(4-methoxyphenyl)carbamoyl]phenyl]benzamide
CID 4796910
2-fluoro-N-[3-[(3-fluorobenzoyl)amino]-4-methoxyphenyl]benzamide
CID 46487214
N-(2,5-dimethoxyphenyl)-4-[(2-phenylacetyl)amino]benzamide
CID 17119475
2-[(4-fluorobenzoyl)amino]-N-(4-methoxyphenyl)benzamide
CID 2227245
N-(4-fluorophenyl)-2-[(4-methoxybenzoyl)amino]benzamide
CID 1307045

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-[2-methoxy-6-(4-phenylbutanoyl)phenyl]benzamide;2-fluoro-N-[5-methoxy-2-(4-phenylbutanoyl)phenyl]benzamide;N-[5-fluoro-2-(4-phenylbutanoyl)phenyl]-4-methoxybenzamide;2-methoxy-N-[2-methoxy-6-(4-phenylbutanoyl)phenyl]benzamide;4-methoxy-N-[5-methoxy-2-(4-phenylbutanoyl)phenyl]benzamide?
The IUPAC name of 2-fluoro-N-[2-methoxy-6-(4-phenylbutanoyl)phenyl]benzamide;2-fluoro-N-[5-methoxy-2-(4-phenylbutanoyl)phenyl]benzamide;N-[5-fluoro-2-(4-phenylbutanoyl)phenyl]-4-methoxybenzamide;2-methoxy-N-[2-methoxy-6-(4-phenylbutanoyl)phenyl]benzamide;4-methoxy-N-[5-methoxy-2-(4-phenylbutanoyl)phenyl]benzamide (CID 158884223) is 2-fluoro-N-[2-methoxy-6-(4-phenylbutanoyl)phenyl]benzamide;2-fluoro-N-[5-methoxy-2-(4-phenylbutanoyl)phenyl]benzamide;N-[5-fluoro-2-(4-phenylbutanoyl)phenyl]-4-methoxybenzamide;2-methoxy-N-[2-methoxy-6-(4-phenylbutanoyl)phenyl]benzamide;4-methoxy-N-[5-methoxy-2-(4-phenylbutanoyl)phenyl]benzamide.
What is the SMILES notation for 2-fluoro-N-[2-methoxy-6-(4-phenylbutanoyl)phenyl]benzamide;2-fluoro-N-[5-methoxy-2-(4-phenylbutanoyl)phenyl]benzamide;N-[5-fluoro-2-(4-phenylbutanoyl)phenyl]-4-methoxybenzamide;2-methoxy-N-[2-methoxy-6-(4-phenylbutanoyl)phenyl]benzamide;4-methoxy-N-[5-methoxy-2-(4-phenylbutanoyl)phenyl]benzamide?
The canonical SMILES for 2-fluoro-N-[2-methoxy-6-(4-phenylbutanoyl)phenyl]benzamide;2-fluoro-N-[5-methoxy-2-(4-phenylbutanoyl)phenyl]benzamide;N-[5-fluoro-2-(4-phenylbutanoyl)phenyl]-4-methoxybenzamide;2-methoxy-N-[2-methoxy-6-(4-phenylbutanoyl)phenyl]benzamide;4-methoxy-N-[5-methoxy-2-(4-phenylbutanoyl)phenyl]benzamide is COc1ccc(C(=O)CCCc2ccccc2)c(NC(=O)c2ccccc2F)c1.COc1ccc(C(=O)Nc2cc(F)ccc2C(=O)CCCc2ccccc2)cc1.COc1ccc(C(=O)Nc2cc(OC)ccc2C(=O)CCCc2ccccc2)cc1.COc1cccc(C(=O)CCCc2ccccc2)c1NC(=O)c1ccccc1F.COc1ccccc1C(=O)Nc1c(OC)cccc1C(=O)CCCc1ccccc1.
What is the InChIKey of 2-fluoro-N-[2-methoxy-6-(4-phenylbutanoyl)phenyl]benzamide;2-fluoro-N-[5-methoxy-2-(4-phenylbutanoyl)phenyl]benzamide;N-[5-fluoro-2-(4-phenylbutanoyl)phenyl]-4-methoxybenzamide;2-methoxy-N-[2-methoxy-6-(4-phenylbutanoyl)phenyl]benzamide;4-methoxy-N-[5-methoxy-2-(4-phenylbutanoyl)phenyl]benzamide?
The InChIKey is JDKIOSIEULNWLK-UHFFFAOYSA-N. The full InChI is InChI=1S/2C25H25NO4.3C24H22FNO3/c1-29-22-16-7-6-13-20(22)25(28)26-24-19(14-9-17-23(24)30-2)21(27)15-8-12-18-10-4-3-5-11-18;1-29-20-13-11-19(12-14-20)25(28)26-23-17-21(30-2)15-16-22(23)24(27)10-6-9-18-7-4-3-5-8-18;1-29-22-16-8-13-19(21(27)15-7-11-17-9-3-2-4-10-17)23(22)26-24(28)18-12-5-6-14-20(18)25;1-29-18-14-15-20(23(27)13-7-10-17-8-3-2-4-9-17)22(16-18)26-24(28)19-11-5-6-12-21(19)25;1-29-20-13-10-18(11-14-20)24(28)26-22-16-19(25)12-15-21(22)23(27)9-5-8-17-6-3-2-4-7-17/h3-7,9-11,13-14,16-17H,8,12,15H2,1-2H3,(H,26,28);3-5,7-8,11-17H,6,9-10H2,1-2H3,(H,26,28);2-6,8-10,12-14,16H,7,11,15H2,1H3,(H,26,28);2-6,8-9,11-12,14-16H,7,10,13H2,1H3,(H,26,28);2-4,6-7,10-16H,5,8-9H2,1H3,(H,26,28).
What are the key properties of 2-fluoro-N-[2-methoxy-6-(4-phenylbutanoyl)phenyl]benzamide;2-fluoro-N-[5-methoxy-2-(4-phenylbutanoyl)phenyl]benzamide;N-[5-fluoro-2-(4-phenylbutanoyl)phenyl]-4-methoxybenzamide;2-methoxy-N-[2-methoxy-6-(4-phenylbutanoyl)phenyl]benzamide;4-methoxy-N-[5-methoxy-2-(4-phenylbutanoyl)phenyl]benzamide?
2-fluoro-N-[2-methoxy-6-(4-phenylbutanoyl)phenyl]benzamide;2-fluoro-N-[5-methoxy-2-(4-phenylbutanoyl)phenyl]benzamide;N-[5-fluoro-2-(4-phenylbutanoyl)phenyl]-4-methoxybenzamide;2-methoxy-N-[2-methoxy-6-(4-phenylbutanoyl)phenyl]benzamide;4-methoxy-N-[5-methoxy-2-(4-phenylbutanoyl)phenyl]benzamide has a molecular weight of 1981.28 g/mol, XLogP of 26.20, 42 rotatable bonds, 5 hydrogen bond donors, and 17 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-[2-methoxy-6-(4-phenylbutanoyl)phenyl]benzamide;2-fluoro-N-[5-methoxy-2-(4-phenylbutanoyl)phenyl]benzamide;N-[5-fluoro-2-(4-phenylbutanoyl)phenyl]-4-methoxybenzamide;2-methoxy-N-[2-methoxy-6-(4-phenylbutanoyl)phenyl]benzamide;4-methoxy-N-[5-methoxy-2-(4-phenylbutanoyl)phenyl]benzamide is sourced from PubChem (CID 158884223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).