3-amino-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-amino-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;3-chloro-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-chloro-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;2-fluoro-4-methoxy-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide

C106H121Cl2FN12O16 — CID 157263578

IUPAC3-amino-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-amino-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;3-chloro-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-chloro-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;2-fluoro-4-methoxy-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide
SMILESCOc1ccc(C(=O)Nc2ccccc2C(=O)CCCN2CCOCC2)c(F)c1.Nc1ccc(C(=O)Nc2ccccc2C(=O)CCCN2CCOCC2)cc1.Nc1cccc(C(=O)Nc2ccccc2C(=O)CCCN2CCOCC2)c1.O=C(Nc1ccccc1C(=O)CCCN1CCOCC1)c1ccc(Cl)cc1.O=C(Nc1ccccc1C(=O)CCCN1CCOCC1)c1cccc(Cl)c1
InChIInChI=1S/C22H25FN2O4.2C21H23ClN2O3.2C21H25N3O3/c1-28-16-8-9-17(19(23)15-16)22(27)24-20-6-3-2-5-18(20)21(26)7-4-10-25-11-13-29-14-12-25;22-17-6-3-5-16(15-17)21(26)23-19-8-2-1-7-18(19)20(25)9-4-10-24-11-13-27-14-12-24;22-17-9-7-16(8-10-17)21(26)23-19-5-2-1-4-18(19)20(25)6-3-11-24-12-14-27-15-13-24;22-17-6-3-5-16(15-17)21(26)23-19-8-2-1-7-18(19)20(25)9-4-10-24-11-13-27-14-12-24;22-17-9-7-16(8-10-17)21(26)23-19-5-2-1-4-18(19)20(25)6-3-11-24-12-14-27-15-13-24/h2-3,5-6,8-9,15H,4,7,10-14H2,1H3,(H,24,27);1-3,5-8,15H,4,9-14H2,(H,23,26);1-2,4-5,7-10H,3,6,11-15H2,(H,23,26);1-3,5-8,15H,4,9-14,22H2,(H,23,26);1-2,4-5,7-10H,3,6,11-15,22H2,(H,23,26)
InChIKeyAXSXZLGDAUAOGN-UHFFFAOYSA-N
MW1909.11 g/mol
LogP16.79
Rot. Bonds36

About 3-amino-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-amino-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;3-chloro-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-chloro-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;2-fluoro-4-methoxy-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide

3-amino-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-amino-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;3-chloro-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-chloro-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;2-fluoro-4-methoxy-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide (PubChem CID 157263578) has the molecular formula C106H121Cl2FN12O16 and a molecular weight of 1909.11 g/mol. Its IUPAC name is 3-amino-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-amino-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;3-chloro-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-chloro-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;2-fluoro-4-methoxy-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide.

Molecular Properties

Compound Name3-amino-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-amino-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;3-chloro-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-chloro-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;2-fluoro-4-methoxy-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide
PubChem CID157263578
Molecular FormulaC106H121Cl2FN12O16
Molecular Weight1909.11 g/mol
Exact Mass1906.84
IUPAC Name3-amino-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-amino-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;3-chloro-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-chloro-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;2-fluoro-4-methoxy-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide
SMILESCOc1ccc(C(=O)Nc2ccccc2C(=O)CCCN2CCOCC2)c(F)c1.Nc1ccc(C(=O)Nc2ccccc2C(=O)CCCN2CCOCC2)cc1.Nc1cccc(C(=O)Nc2ccccc2C(=O)CCCN2CCOCC2)c1.O=C(Nc1ccccc1C(=O)CCCN1CCOCC1)c1ccc(Cl)cc1.O=C(Nc1ccccc1C(=O)CCCN1CCOCC1)c1cccc(Cl)c1
InChIInChI=1S/C22H25FN2O4.2C21H23ClN2O3.2C21H25N3O3/c1-28-16-8-9-17(19(23)15-16)22(27)24-20-6-3-2-5-18(20)21(26)7-4-10-25-11-13-29-14-12-25;22-17-6-3-5-16(15-17)21(26)23-19-8-2-1-7-18(19)20(25)9-4-10-24-11-13-27-14-12-24;22-17-9-7-16(8-10-17)21(26)23-19-5-2-1-4-18(19)20(25)6-3-11-24-12-14-27-15-13-24;22-17-6-3-5-16(15-17)21(26)23-19-8-2-1-7-18(19)20(25)9-4-10-24-11-13-27-14-12-24;22-17-9-7-16(8-10-17)21(26)23-19-5-2-1-4-18(19)20(25)6-3-11-24-12-14-27-15-13-24/h2-3,5-6,8-9,15H,4,7,10-14H2,1H3,(H,24,27);1-3,5-8,15H,4,9-14H2,(H,23,26);1-2,4-5,7-10H,3,6,11-15H2,(H,23,26);1-3,5-8,15H,4,9-14,22H2,(H,23,26);1-2,4-5,7-10H,3,6,11-15,22H2,(H,23,26)
InChIKeyAXSXZLGDAUAOGN-UHFFFAOYSA-N
XLogP16.79
TPSA354.47 Ų
H-Bond Donors7
H-Bond Acceptors23
Rotatable Bonds36
Heavy Atoms137
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001909.11
LogP ≤ 516.79
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1023

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

Analyze 3-amino-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-amino-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;3-chloro-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-chloro-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;2-fluoro-4-methoxy-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-amino-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;3-chloro-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-chloro-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;2-fluoro-4-methoxy-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide?
The IUPAC name of 3-amino-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-amino-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;3-chloro-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-chloro-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;2-fluoro-4-methoxy-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide (CID 157263578) is 3-amino-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-amino-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;3-chloro-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-chloro-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;2-fluoro-4-methoxy-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide.
What is the SMILES notation for 3-amino-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-amino-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;3-chloro-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-chloro-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;2-fluoro-4-methoxy-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide?
The canonical SMILES for 3-amino-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-amino-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;3-chloro-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-chloro-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;2-fluoro-4-methoxy-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide is COc1ccc(C(=O)Nc2ccccc2C(=O)CCCN2CCOCC2)c(F)c1.Nc1ccc(C(=O)Nc2ccccc2C(=O)CCCN2CCOCC2)cc1.Nc1cccc(C(=O)Nc2ccccc2C(=O)CCCN2CCOCC2)c1.O=C(Nc1ccccc1C(=O)CCCN1CCOCC1)c1ccc(Cl)cc1.O=C(Nc1ccccc1C(=O)CCCN1CCOCC1)c1cccc(Cl)c1.
What is the InChIKey of 3-amino-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-amino-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;3-chloro-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-chloro-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;2-fluoro-4-methoxy-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide?
The InChIKey is AXSXZLGDAUAOGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25FN2O4.2C21H23ClN2O3.2C21H25N3O3/c1-28-16-8-9-17(19(23)15-16)22(27)24-20-6-3-2-5-18(20)21(26)7-4-10-25-11-13-29-14-12-25;22-17-6-3-5-16(15-17)21(26)23-19-8-2-1-7-18(19)20(25)9-4-10-24-11-13-27-14-12-24;22-17-9-7-16(8-10-17)21(26)23-19-5-2-1-4-18(19)20(25)6-3-11-24-12-14-27-15-13-24;22-17-6-3-5-16(15-17)21(26)23-19-8-2-1-7-18(19)20(25)9-4-10-24-11-13-27-14-12-24;22-17-9-7-16(8-10-17)21(26)23-19-5-2-1-4-18(19)20(25)6-3-11-24-12-14-27-15-13-24/h2-3,5-6,8-9,15H,4,7,10-14H2,1H3,(H,24,27);1-3,5-8,15H,4,9-14H2,(H,23,26);1-2,4-5,7-10H,3,6,11-15H2,(H,23,26);1-3,5-8,15H,4,9-14,22H2,(H,23,26);1-2,4-5,7-10H,3,6,11-15,22H2,(H,23,26).
What are the key properties of 3-amino-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-amino-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;3-chloro-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-chloro-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;2-fluoro-4-methoxy-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide?
3-amino-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-amino-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;3-chloro-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-chloro-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;2-fluoro-4-methoxy-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide has a molecular weight of 1909.11 g/mol, XLogP of 16.79, 36 rotatable bonds, 7 hydrogen bond donors, and 23 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-amino-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;3-chloro-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;4-chloro-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide;2-fluoro-4-methoxy-N-[2-(4-morpholin-4-ylbutanoyl)phenyl]benzamide is sourced from PubChem (CID 157263578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).