N-[2-amino-5-(4-fluorophenyl)phenyl]-4-[4-(2,3-dihydropyridin-2-yl)oxan-4-yl]benzamide;N-[2-amino-5-(4-fluorophenyl)phenyl]-4-[4-(2H-tetrazol-5-yl)oxan-4-yl]benzamide;N-(2-aminophenyl)-4-[4-(2,3-dihydropyridin-2-yl)oxan-4-yl]benzamide;N-(2-aminophenyl)-4-[4-(2H-tetrazol-5-yl)oxan-4-yl]benzamide;N-(2-amino-5-thiophen-2-ylphenyl)-4-[4-(2,3-dihydropyridin-2-yl)oxan-4-yl]benzamide

C123H123F2N21O10S — CID 159542207

IUPACN-[2-amino-5-(4-fluorophenyl)phenyl]-4-[4-(2,3-dihydropyridin-2-yl)oxan-4-yl]benzamide;N-[2-amino-5-(4-fluorophenyl)phenyl]-4-[4-(2H-tetrazol-5-yl)oxan-4-yl]benzamide;N-(2-aminophenyl)-4-[4-(2,3-dihydropyridin-2-yl)oxan-4-yl]benzamide;N-(2-aminophenyl)-4-[4-(2H-tetrazol-5-yl)oxan-4-yl]benzamide;N-(2-amino-5-thiophen-2-ylphenyl)-4-[4-(2,3-dihydropyridin-2-yl)oxan-4-yl]benzamide
SMILESNc1ccc(-c2ccc(F)cc2)cc1NC(=O)c1ccc(C2(C3CC=CC=N3)CCOCC2)cc1.Nc1ccc(-c2ccc(F)cc2)cc1NC(=O)c1ccc(C2(c3nn[nH]n3)CCOCC2)cc1.Nc1ccc(-c2cccs2)cc1NC(=O)c1ccc(C2(C3CC=CC=N3)CCOCC2)cc1.Nc1ccccc1NC(=O)c1ccc(C2(C3CC=CC=N3)CCOCC2)cc1.Nc1ccccc1NC(=O)c1ccc(C2(c3nn[nH]n3)CCOCC2)cc1
InChIInChI=1S/C29H28FN3O2.C27H27N3O2S.C25H23FN6O2.C23H25N3O2.C19H20N6O2/c30-24-11-6-20(7-12-24)22-8-13-25(31)26(19-22)33-28(34)21-4-9-23(10-5-21)29(14-17-35-18-15-29)27-3-1-2-16-32-27;28-22-11-8-20(24-4-3-17-33-24)18-23(22)30-26(31)19-6-9-21(10-7-19)27(12-15-32-16-13-27)25-5-1-2-14-29-25;26-20-8-3-16(4-9-20)18-5-10-21(27)22(15-18)28-23(33)17-1-6-19(7-2-17)25(11-13-34-14-12-25)24-29-31-32-30-24;24-19-5-1-2-6-20(19)26-22(27)17-8-10-18(11-9-17)23(12-15-28-16-13-23)21-7-3-4-14-25-21;20-15-3-1-2-4-16(15)21-17(26)13-5-7-14(8-6-13)19(9-11-27-12-10-19)18-22-24-25-23-18/h1-2,4-13,16,19,27H,3,14-15,17-18,31H2,(H,33,34);1-4,6-11,14,17-18,25H,5,12-13,15-16,28H2,(H,30,31);1-10,15H,11-14,27H2,(H,28,33)(H,29,30,31,32);1-6,8-11,14,21H,7,12-13,15-16,24H2,(H,26,27);1-8H,9-12,20H2,(H,21,26)(H,22,23,24,25)
InChIKeyMEIYLKWJETXMLE-UHFFFAOYSA-N
MW2125.54 g/mol
LogP21.51
Rot. Bonds23

About N-[2-amino-5-(4-fluorophenyl)phenyl]-4-[4-(2,3-dihydropyridin-2-yl)oxan-4-yl]benzamide;N-[2-amino-5-(4-fluorophenyl)phenyl]-4-[4-(2H-tetrazol-5-yl)oxan-4-yl]benzamide;N-(2-aminophenyl)-4-[4-(2,3-dihydropyridin-2-yl)oxan-4-yl]benzamide;N-(2-aminophenyl)-4-[4-(2H-tetrazol-5-yl)oxan-4-yl]benzamide;N-(2-amino-5-thiophen-2-ylphenyl)-4-[4-(2,3-dihydropyridin-2-yl)oxan-4-yl]benzamide

N-[2-amino-5-(4-fluorophenyl)phenyl]-4-[4-(2,3-dihydropyridin-2-yl)oxan-4-yl]benzamide;N-[2-amino-5-(4-fluorophenyl)phenyl]-4-[4-(2H-tetrazol-5-yl)oxan-4-yl]benzamide;N-(2-aminophenyl)-4-[4-(2,3-dihydropyridin-2-yl)oxan-4-yl]benzamide;N-(2-aminophenyl)-4-[4-(2H-tetrazol-5-yl)oxan-4-yl]benzamide;N-(2-amino-5-thiophen-2-ylphenyl)-4-[4-(2,3-dihydropyridin-2-yl)oxan-4-yl]benzamide (PubChem CID 159542207) has the molecular formula C123H123F2N21O10S and a molecular weight of 2125.54 g/mol. Its IUPAC name is N-[2-amino-5-(4-fluorophenyl)phenyl]-4-[4-(2,3-dihydropyridin-2-yl)oxan-4-yl]benzamide;N-[2-amino-5-(4-fluorophenyl)phenyl]-4-[4-(2H-tetrazol-5-yl)oxan-4-yl]benzamide;N-(2-aminophenyl)-4-[4-(2,3-dihydropyridin-2-yl)oxan-4-yl]benzamide;N-(2-aminophenyl)-4-[4-(2H-tetrazol-5-yl)oxan-4-yl]benzamide;N-(2-amino-5-thiophen-2-ylphenyl)-4-[4-(2,3-dihydropyridin-2-yl)oxan-4-yl]benzamide.

Molecular Properties

Compound NameN-[2-amino-5-(4-fluorophenyl)phenyl]-4-[4-(2,3-dihydropyridin-2-yl)oxan-4-yl]benzamide;N-[2-amino-5-(4-fluorophenyl)phenyl]-4-[4-(2H-tetrazol-5-yl)oxan-4-yl]benzamide;N-(2-aminophenyl)-4-[4-(2,3-dihydropyridin-2-yl)oxan-4-yl]benzamide;N-(2-aminophenyl)-4-[4-(2H-tetrazol-5-yl)oxan-4-yl]benzamide;N-(2-amino-5-thiophen-2-ylphenyl)-4-[4-(2,3-dihydropyridin-2-yl)oxan-4-yl]benzamide
PubChem CID159542207
Molecular FormulaC123H123F2N21O10S
Molecular Weight2125.54 g/mol
Exact Mass2123.95
IUPAC NameN-[2-amino-5-(4-fluorophenyl)phenyl]-4-[4-(2,3-dihydropyridin-2-yl)oxan-4-yl]benzamide;N-[2-amino-5-(4-fluorophenyl)phenyl]-4-[4-(2H-tetrazol-5-yl)oxan-4-yl]benzamide;N-(2-aminophenyl)-4-[4-(2,3-dihydropyridin-2-yl)oxan-4-yl]benzamide;N-(2-aminophenyl)-4-[4-(2H-tetrazol-5-yl)oxan-4-yl]benzamide;N-(2-amino-5-thiophen-2-ylphenyl)-4-[4-(2,3-dihydropyridin-2-yl)oxan-4-yl]benzamide
SMILESNc1ccc(-c2ccc(F)cc2)cc1NC(=O)c1ccc(C2(C3CC=CC=N3)CCOCC2)cc1.Nc1ccc(-c2ccc(F)cc2)cc1NC(=O)c1ccc(C2(c3nn[nH]n3)CCOCC2)cc1.Nc1ccc(-c2cccs2)cc1NC(=O)c1ccc(C2(C3CC=CC=N3)CCOCC2)cc1.Nc1ccccc1NC(=O)c1ccc(C2(C3CC=CC=N3)CCOCC2)cc1.Nc1ccccc1NC(=O)c1ccc(C2(c3nn[nH]n3)CCOCC2)cc1
InChIInChI=1S/C29H28FN3O2.C27H27N3O2S.C25H23FN6O2.C23H25N3O2.C19H20N6O2/c30-24-11-6-20(7-12-24)22-8-13-25(31)26(19-22)33-28(34)21-4-9-23(10-5-21)29(14-17-35-18-15-29)27-3-1-2-16-32-27;28-22-11-8-20(24-4-3-17-33-24)18-23(22)30-26(31)19-6-9-21(10-7-19)27(12-15-32-16-13-27)25-5-1-2-14-29-25;26-20-8-3-16(4-9-20)18-5-10-21(27)22(15-18)28-23(33)17-1-6-19(7-2-17)25(11-13-34-14-12-25)24-29-31-32-30-24;24-19-5-1-2-6-20(19)26-22(27)17-8-10-18(11-9-17)23(12-15-28-16-13-23)21-7-3-4-14-25-21;20-15-3-1-2-4-16(15)21-17(26)13-5-7-14(8-6-13)19(9-11-27-12-10-19)18-22-24-25-23-18/h1-2,4-13,16,19,27H,3,14-15,17-18,31H2,(H,33,34);1-4,6-11,14,17-18,25H,5,12-13,15-16,28H2,(H,30,31);1-10,15H,11-14,27H2,(H,28,33)(H,29,30,31,32);1-6,8-11,14,21H,7,12-13,15-16,24H2,(H,26,27);1-8H,9-12,20H2,(H,21,26)(H,22,23,24,25)
InChIKeyMEIYLKWJETXMLE-UHFFFAOYSA-N
XLogP21.51
TPSA467.75 Ų
H-Bond Donors12
H-Bond Acceptors25
Rotatable Bonds23
Heavy Atoms157
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002125.54
LogP ≤ 521.51
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1025

Computed Properties (RDKit)

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

Analyze N-[2-amino-5-(4-fluorophenyl)phenyl]-4-[4-(2,3-dihydropyridin-2-yl)oxan-4-yl]benzamide;N-[2-amino-5-(4-fluorophenyl)phenyl]-4-[4-(2H-tetrazol-5-yl)oxan-4-yl]benzamide;N-(2-aminophenyl)-4-[4-(2,3-dihydropyridin-2-yl)oxan-4-yl]benzamide;N-(2-aminophenyl)-4-[4-(2H-tetrazol-5-yl)oxan-4-yl]benzamide;N-(2-amino-5-thiophen-2-ylphenyl)-4-[4-(2,3-dihydropyridin-2-yl)oxan-4-yl]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

N-[2-amino-5-(4-fluorophenyl)phenyl]-4-[4-(5-methyl-1H-1,2,4-triazol-3-yl)oxan-4-yl]benzamide
CID 67962233
4-[4-(5-acetyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)oxan-4-yl]-N-(2-amino-5-thiophen-2-ylphenyl)benzamide
CID 44623603
4-[4-(5-acetyl-4-methyl-1,3-thiazol-2-yl)oxan-4-yl]-N-[2-amino-5-(4-fluorophenyl)phenyl]benzamide
CID 59160926
N-(2-aminophenyl)-4-[4-(4-pyridin-3-yl-1,3-thiazol-2-yl)oxan-4-yl]benzamide
CID 59160914
[2-[[4-[4-(1,3-thiazol-2-yl)oxan-4-yl]benzoyl]amino]-4-thiophen-2-ylphenyl]carbamic acid
CID 140576462
N-(2-amino-5-thiophen-2-ylphenyl)-4-(3-cyclopropyl-3-oxopropyl)benzamide
CID 59627263
N-(2-amino-5-thiophen-2-ylphenyl)-4-[3-[(5R)-3,3-dimethyl-1,3-azasilolidin-5-yl]-3-oxopropyl]benzamide
CID 58283991
N-(2-amino-5-thiophen-2-ylphenyl)-4-methylsulfanylbenzamide
CID 168913825
[4-[(2-amino-5-thiophen-2-ylphenyl)carbamoyl]phenyl]methoxy-(4-fluorophenyl)-oxophosphanium
CID 69091409
N-(2-amino-5-thiophen-2-ylphenyl)-6-(2-oxo-1,8-dioxa-3-azaspiro[4.5]decan-3-yl)pyridine-3-carboxamide
CID 139460390
N-(2-amino-5-thiophen-2-ylphenyl)-4-(benzamidomethyl)benzamide
CID 25157373
N-(2-amino-5-thiophen-2-ylphenyl)-4-(3-trimethylsilylpropyl)benzamide
CID 58283961

Frequently Asked Questions

What is the IUPAC name of N-[2-amino-5-(4-fluorophenyl)phenyl]-4-[4-(2,3-dihydropyridin-2-yl)oxan-4-yl]benzamide;N-[2-amino-5-(4-fluorophenyl)phenyl]-4-[4-(2H-tetrazol-5-yl)oxan-4-yl]benzamide;N-(2-aminophenyl)-4-[4-(2,3-dihydropyridin-2-yl)oxan-4-yl]benzamide;N-(2-aminophenyl)-4-[4-(2H-tetrazol-5-yl)oxan-4-yl]benzamide;N-(2-amino-5-thiophen-2-ylphenyl)-4-[4-(2,3-dihydropyridin-2-yl)oxan-4-yl]benzamide?
The IUPAC name of N-[2-amino-5-(4-fluorophenyl)phenyl]-4-[4-(2,3-dihydropyridin-2-yl)oxan-4-yl]benzamide;N-[2-amino-5-(4-fluorophenyl)phenyl]-4-[4-(2H-tetrazol-5-yl)oxan-4-yl]benzamide;N-(2-aminophenyl)-4-[4-(2,3-dihydropyridin-2-yl)oxan-4-yl]benzamide;N-(2-aminophenyl)-4-[4-(2H-tetrazol-5-yl)oxan-4-yl]benzamide;N-(2-amino-5-thiophen-2-ylphenyl)-4-[4-(2,3-dihydropyridin-2-yl)oxan-4-yl]benzamide (CID 159542207) is N-[2-amino-5-(4-fluorophenyl)phenyl]-4-[4-(2,3-dihydropyridin-2-yl)oxan-4-yl]benzamide;N-[2-amino-5-(4-fluorophenyl)phenyl]-4-[4-(2H-tetrazol-5-yl)oxan-4-yl]benzamide;N-(2-aminophenyl)-4-[4-(2,3-dihydropyridin-2-yl)oxan-4-yl]benzamide;N-(2-aminophenyl)-4-[4-(2H-tetrazol-5-yl)oxan-4-yl]benzamide;N-(2-amino-5-thiophen-2-ylphenyl)-4-[4-(2,3-dihydropyridin-2-yl)oxan-4-yl]benzamide.
What is the SMILES notation for N-[2-amino-5-(4-fluorophenyl)phenyl]-4-[4-(2,3-dihydropyridin-2-yl)oxan-4-yl]benzamide;N-[2-amino-5-(4-fluorophenyl)phenyl]-4-[4-(2H-tetrazol-5-yl)oxan-4-yl]benzamide;N-(2-aminophenyl)-4-[4-(2,3-dihydropyridin-2-yl)oxan-4-yl]benzamide;N-(2-aminophenyl)-4-[4-(2H-tetrazol-5-yl)oxan-4-yl]benzamide;N-(2-amino-5-thiophen-2-ylphenyl)-4-[4-(2,3-dihydropyridin-2-yl)oxan-4-yl]benzamide?
The canonical SMILES for N-[2-amino-5-(4-fluorophenyl)phenyl]-4-[4-(2,3-dihydropyridin-2-yl)oxan-4-yl]benzamide;N-[2-amino-5-(4-fluorophenyl)phenyl]-4-[4-(2H-tetrazol-5-yl)oxan-4-yl]benzamide;N-(2-aminophenyl)-4-[4-(2,3-dihydropyridin-2-yl)oxan-4-yl]benzamide;N-(2-aminophenyl)-4-[4-(2H-tetrazol-5-yl)oxan-4-yl]benzamide;N-(2-amino-5-thiophen-2-ylphenyl)-4-[4-(2,3-dihydropyridin-2-yl)oxan-4-yl]benzamide is Nc1ccc(-c2ccc(F)cc2)cc1NC(=O)c1ccc(C2(C3CC=CC=N3)CCOCC2)cc1.Nc1ccc(-c2ccc(F)cc2)cc1NC(=O)c1ccc(C2(c3nn[nH]n3)CCOCC2)cc1.Nc1ccc(-c2cccs2)cc1NC(=O)c1ccc(C2(C3CC=CC=N3)CCOCC2)cc1.Nc1ccccc1NC(=O)c1ccc(C2(C3CC=CC=N3)CCOCC2)cc1.Nc1ccccc1NC(=O)c1ccc(C2(c3nn[nH]n3)CCOCC2)cc1.
What is the InChIKey of N-[2-amino-5-(4-fluorophenyl)phenyl]-4-[4-(2,3-dihydropyridin-2-yl)oxan-4-yl]benzamide;N-[2-amino-5-(4-fluorophenyl)phenyl]-4-[4-(2H-tetrazol-5-yl)oxan-4-yl]benzamide;N-(2-aminophenyl)-4-[4-(2,3-dihydropyridin-2-yl)oxan-4-yl]benzamide;N-(2-aminophenyl)-4-[4-(2H-tetrazol-5-yl)oxan-4-yl]benzamide;N-(2-amino-5-thiophen-2-ylphenyl)-4-[4-(2,3-dihydropyridin-2-yl)oxan-4-yl]benzamide?
The InChIKey is MEIYLKWJETXMLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H28FN3O2.C27H27N3O2S.C25H23FN6O2.C23H25N3O2.C19H20N6O2/c30-24-11-6-20(7-12-24)22-8-13-25(31)26(19-22)33-28(34)21-4-9-23(10-5-21)29(14-17-35-18-15-29)27-3-1-2-16-32-27;28-22-11-8-20(24-4-3-17-33-24)18-23(22)30-26(31)19-6-9-21(10-7-19)27(12-15-32-16-13-27)25-5-1-2-14-29-25;26-20-8-3-16(4-9-20)18-5-10-21(27)22(15-18)28-23(33)17-1-6-19(7-2-17)25(11-13-34-14-12-25)24-29-31-32-30-24;24-19-5-1-2-6-20(19)26-22(27)17-8-10-18(11-9-17)23(12-15-28-16-13-23)21-7-3-4-14-25-21;20-15-3-1-2-4-16(15)21-17(26)13-5-7-14(8-6-13)19(9-11-27-12-10-19)18-22-24-25-23-18/h1-2,4-13,16,19,27H,3,14-15,17-18,31H2,(H,33,34);1-4,6-11,14,17-18,25H,5,12-13,15-16,28H2,(H,30,31);1-10,15H,11-14,27H2,(H,28,33)(H,29,30,31,32);1-6,8-11,14,21H,7,12-13,15-16,24H2,(H,26,27);1-8H,9-12,20H2,(H,21,26)(H,22,23,24,25).
What are the key properties of N-[2-amino-5-(4-fluorophenyl)phenyl]-4-[4-(2,3-dihydropyridin-2-yl)oxan-4-yl]benzamide;N-[2-amino-5-(4-fluorophenyl)phenyl]-4-[4-(2H-tetrazol-5-yl)oxan-4-yl]benzamide;N-(2-aminophenyl)-4-[4-(2,3-dihydropyridin-2-yl)oxan-4-yl]benzamide;N-(2-aminophenyl)-4-[4-(2H-tetrazol-5-yl)oxan-4-yl]benzamide;N-(2-amino-5-thiophen-2-ylphenyl)-4-[4-(2,3-dihydropyridin-2-yl)oxan-4-yl]benzamide?
N-[2-amino-5-(4-fluorophenyl)phenyl]-4-[4-(2,3-dihydropyridin-2-yl)oxan-4-yl]benzamide;N-[2-amino-5-(4-fluorophenyl)phenyl]-4-[4-(2H-tetrazol-5-yl)oxan-4-yl]benzamide;N-(2-aminophenyl)-4-[4-(2,3-dihydropyridin-2-yl)oxan-4-yl]benzamide;N-(2-aminophenyl)-4-[4-(2H-tetrazol-5-yl)oxan-4-yl]benzamide;N-(2-amino-5-thiophen-2-ylphenyl)-4-[4-(2,3-dihydropyridin-2-yl)oxan-4-yl]benzamide has a molecular weight of 2125.54 g/mol, XLogP of 21.51, 23 rotatable bonds, 12 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-amino-5-(4-fluorophenyl)phenyl]-4-[4-(2,3-dihydropyridin-2-yl)oxan-4-yl]benzamide;N-[2-amino-5-(4-fluorophenyl)phenyl]-4-[4-(2H-tetrazol-5-yl)oxan-4-yl]benzamide;N-(2-aminophenyl)-4-[4-(2,3-dihydropyridin-2-yl)oxan-4-yl]benzamide;N-(2-aminophenyl)-4-[4-(2H-tetrazol-5-yl)oxan-4-yl]benzamide;N-(2-amino-5-thiophen-2-ylphenyl)-4-[4-(2,3-dihydropyridin-2-yl)oxan-4-yl]benzamide is sourced from PubChem (CID 159542207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).