3-tert-butyl-N,N-dimethyl-5-(methylamino)benzamide;3-tert-butyl-N-methyl-5-(methylamino)benzamide;3-tert-butyl-N-methyl-5-(methylamino)-N-propylbenzamide;3-chloro-N,N-dimethyl-5-(methylamino)benzamide;3-chloro-N-methyl-5-(methylamino)benzamide;N-ethyl-N,3-dimethyl-5-(methylamino)benzamide;3-fluoro-N,N-dimethyl-5-(methylamino)benzamide;3-fluoro-N-methyl-5-(methylamino)benzamide;3-methoxy-N,N-dimethyl-5-(methylamino)benzamide;3-methoxy-N-methyl-5-(methylamino)benzamide;2-methoxy-N-methyl-5-(methylamino)-N-propylbenzamide

C127H184Cl2F2N22O14 — CID 159765125

About 3-tert-butyl-N,N-dimethyl-5-(methylamino)benzamide;3-tert-butyl-N-methyl-5-(methylamino)benzamide;3-tert-butyl-N-methyl-5-(methylamino)-N-propylbenzamide;3-chloro-N,N-dimethyl-5-(methylamino)benzamide;3-chloro-N-methyl-5-(methylamino)benzamide;N-ethyl-N,3-dimethyl-5-(methylamino)benzamide;3-fluoro-N,N-dimethyl-5-(methylamino)benzamide;3-fluoro-N-methyl-5-(methylamino)benzamide;3-methoxy-N,N-dimethyl-5-(methylamino)benzamide;3-methoxy-N-methyl-5-(methylamino)benzamide;2-methoxy-N-methyl-5-(methylamino)-N-propylbenzamide

3-tert-butyl-N,N-dimethyl-5-(methylamino)benzamide;3-tert-butyl-N-methyl-5-(methylamino)benzamide;3-tert-butyl-N-methyl-5-(methylamino)-N-propylbenzamide;3-chloro-N,N-dimethyl-5-(methylamino)benzamide;3-chloro-N-methyl-5-(methylamino)benzamide;N-ethyl-N,3-dimethyl-5-(methylamino)benzamide;3-fluoro-N,N-dimethyl-5-(methylamino)benzamide;3-fluoro-N-methyl-5-(methylamino)benzamide;3-methoxy-N,N-dimethyl-5-(methylamino)benzamide;3-methoxy-N-methyl-5-(methylamino)benzamide;2-methoxy-N-methyl-5-(methylamino)-N-propylbenzamide (PubChem CID 159765125) has the molecular formula C127H184Cl2F2N22O14 and a molecular weight of 2351.91 g/mol. Its IUPAC name is 3-tert-butyl-N,N-dimethyl-5-(methylamino)benzamide;3-tert-butyl-N-methyl-5-(methylamino)benzamide;3-tert-butyl-N-methyl-5-(methylamino)-N-propylbenzamide;3-chloro-N,N-dimethyl-5-(methylamino)benzamide;3-chloro-N-methyl-5-(methylamino)benzamide;N-ethyl-N,3-dimethyl-5-(methylamino)benzamide;3-fluoro-N,N-dimethyl-5-(methylamino)benzamide;3-fluoro-N-methyl-5-(methylamino)benzamide;3-methoxy-N,N-dimethyl-5-(methylamino)benzamide;3-methoxy-N-methyl-5-(methylamino)benzamide;2-methoxy-N-methyl-5-(methylamino)-N-propylbenzamide.

Molecular Properties

• Compound Name: 3-tert-butyl-N,N-dimethyl-5-(methylamino)benzamide;3-tert-butyl-N-methyl-5-(methylamino)benzamide;3-tert-butyl-N-methyl-5-(methylamino)-N-propylbenzamide;3-chloro-N,N-dimethyl-5-(methylamino)benzamide;3-chloro-N-methyl-5-(methylamino)benzamide;N-ethyl-N,3-dimethyl-5-(methylamino)benzamide;3-fluoro-N,N-dimethyl-5-(methylamino)benzamide;3-fluoro-N-methyl-5-(methylamino)benzamide;3-methoxy-N,N-dimethyl-5-(methylamino)benzamide;3-methoxy-N-methyl-5-(methylamino)benzamide;2-methoxy-N-methyl-5-(methylamino)-N-propylbenzamide
• PubChem CID: 159765125
• Molecular Formula: C127H184Cl2F2N22O14
• Molecular Weight: 2351.91 g/mol
• Exact Mass: 2349.37
• IUPAC Name: 3-tert-butyl-N,N-dimethyl-5-(methylamino)benzamide;3-tert-butyl-N-methyl-5-(methylamino)benzamide;3-tert-butyl-N-methyl-5-(methylamino)-N-propylbenzamide;3-chloro-N,N-dimethyl-5-(methylamino)benzamide;3-chloro-N-methyl-5-(methylamino)benzamide;N-ethyl-N,3-dimethyl-5-(methylamino)benzamide;3-fluoro-N,N-dimethyl-5-(methylamino)benzamide;3-fluoro-N-methyl-5-(methylamino)benzamide;3-methoxy-N,N-dimethyl-5-(methylamino)benzamide;3-methoxy-N-methyl-5-(methylamino)benzamide;2-methoxy-N-methyl-5-(methylamino)-N-propylbenzamide
• SMILES: CCCN(C)C(=O)c1cc(NC)cc(C(C)(C)C)c1.CCCN(C)C(=O)c1cc(NC)ccc1OC.CCN(C)C(=O)c1cc(C)cc(NC)c1.CNC(=O)c1cc(Cl)cc(NC)c1.CNC(=O)c1cc(F)cc(NC)c1.CNC(=O)c1cc(NC)cc(C(C)(C)C)c1.CNC(=O)c1cc(NC)cc(OC)c1.CNc1cc(C(=O)N(C)C)cc(C(C)(C)C)c1.CNc1cc(Cl)cc(C(=O)N(C)C)c1.CNc1cc(F)cc(C(=O)N(C)C)c1.CNc1cc(OC)cc(C(=O)N(C)C)c1
• InChI: InChI=1S/C16H26N2O.C14H22N2O.C13H20N2O2.C13H20N2O.C12H18N2O.C11H16N2O2.C10H13ClN2O.C10H13FN2O.C10H14N2O2.C9H11ClN2O.C9H11FN2O/c1-7-8-18(6)15(19)12-9-13(16(2,3)4)11-14(10-12)17-5;1-14(2,3)11-7-10(13(17)16(5)6)8-12(9-11)15-4;1-5-8-15(3)13(16)11-9-10(14-2)6-7-12(11)17-4;1-13(2,3)10-6-9(12(16)15-5)7-11(8-10)14-4;1-5-14(4)12(15)10-6-9(2)7-11(8-10)13-3;1-12-9-5-8(11(14)13(2)3)6-10(7-9)15-4;2*1-12-9-5-7(4-8(11)6-9)10(14)13(2)3;1-11-8-4-7(10(13)12-2)5-9(6-8)14-3;2*1-11-8-4-6(9(13)12-2)3-7(10)5-8/h9-11,17H,7-8H2,1-6H3;7-9,15H,1-6H3;6-7,9,14H,5,8H2,1-4H3;6-8,14H,1-5H3,(H,15,16);6-8,13H,5H2,1-4H3;5-7,12H,1-4H3;2*4-6,12H,1-3H3;4-6,11H,1-3H3,(H,12,13);2*3-5,11H,1-2H3,(H,12,13)
• InChIKey: NFJYYTMPQMSUTJ-UHFFFAOYSA-N
• XLogP: 22.12
• TPSA: 418.59 Ų
• H-Bond Donors: 15
• H-Bond Acceptors: 25
• Rotatable Bonds: 30
• Heavy Atoms: 167
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2351.91
LogP ≤ 5	22.12
H-Bond Donors ≤ 5	15
H-Bond Acceptors ≤ 10	25

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 3-tert-butyl-N,N-dimethyl-5-(methylamino)benzamide;3-tert-butyl-N-methyl-5-(methylamino)benzamide;3-tert-butyl-N-methyl-5-(methylamino)-N-propylbenzamide;3-chloro-N,N-dimethyl-5-(methylamino)benzamide;3-chloro-N-methyl-5-(methylamino)benzamide;N-ethyl-N,3-dimethyl-5-(methylamino)benzamide;3-fluoro-N,N-dimethyl-5-(methylamino)benzamide;3-fluoro-N-methyl-5-(methylamino)benzamide;3-methoxy-N,N-dimethyl-5-(methylamino)benzamide;3-methoxy-N-methyl-5-(methylamino)benzamide;2-methoxy-N-methyl-5-(methylamino)-N-propylbenzamide?

The IUPAC name of 3-tert-butyl-N,N-dimethyl-5-(methylamino)benzamide;3-tert-butyl-N-methyl-5-(methylamino)benzamide;3-tert-butyl-N-methyl-5-(methylamino)-N-propylbenzamide;3-chloro-N,N-dimethyl-5-(methylamino)benzamide;3-chloro-N-methyl-5-(methylamino)benzamide;N-ethyl-N,3-dimethyl-5-(methylamino)benzamide;3-fluoro-N,N-dimethyl-5-(methylamino)benzamide;3-fluoro-N-methyl-5-(methylamino)benzamide;3-methoxy-N,N-dimethyl-5-(methylamino)benzamide;3-methoxy-N-methyl-5-(methylamino)benzamide;2-methoxy-N-methyl-5-(methylamino)-N-propylbenzamide (CID 159765125) is 3-tert-butyl-N,N-dimethyl-5-(methylamino)benzamide;3-tert-butyl-N-methyl-5-(methylamino)benzamide;3-tert-butyl-N-methyl-5-(methylamino)-N-propylbenzamide;3-chloro-N,N-dimethyl-5-(methylamino)benzamide;3-chloro-N-methyl-5-(methylamino)benzamide;N-ethyl-N,3-dimethyl-5-(methylamino)benzamide;3-fluoro-N,N-dimethyl-5-(methylamino)benzamide;3-fluoro-N-methyl-5-(methylamino)benzamide;3-methoxy-N,N-dimethyl-5-(methylamino)benzamide;3-methoxy-N-methyl-5-(methylamino)benzamide;2-methoxy-N-methyl-5-(methylamino)-N-propylbenzamide.

What is the SMILES notation for 3-tert-butyl-N,N-dimethyl-5-(methylamino)benzamide;3-tert-butyl-N-methyl-5-(methylamino)benzamide;3-tert-butyl-N-methyl-5-(methylamino)-N-propylbenzamide;3-chloro-N,N-dimethyl-5-(methylamino)benzamide;3-chloro-N-methyl-5-(methylamino)benzamide;N-ethyl-N,3-dimethyl-5-(methylamino)benzamide;3-fluoro-N,N-dimethyl-5-(methylamino)benzamide;3-fluoro-N-methyl-5-(methylamino)benzamide;3-methoxy-N,N-dimethyl-5-(methylamino)benzamide;3-methoxy-N-methyl-5-(methylamino)benzamide;2-methoxy-N-methyl-5-(methylamino)-N-propylbenzamide?

The canonical SMILES for 3-tert-butyl-N,N-dimethyl-5-(methylamino)benzamide;3-tert-butyl-N-methyl-5-(methylamino)benzamide;3-tert-butyl-N-methyl-5-(methylamino)-N-propylbenzamide;3-chloro-N,N-dimethyl-5-(methylamino)benzamide;3-chloro-N-methyl-5-(methylamino)benzamide;N-ethyl-N,3-dimethyl-5-(methylamino)benzamide;3-fluoro-N,N-dimethyl-5-(methylamino)benzamide;3-fluoro-N-methyl-5-(methylamino)benzamide;3-methoxy-N,N-dimethyl-5-(methylamino)benzamide;3-methoxy-N-methyl-5-(methylamino)benzamide;2-methoxy-N-methyl-5-(methylamino)-N-propylbenzamide is CCCN(C)C(=O)c1cc(NC)cc(C(C)(C)C)c1.CCCN(C)C(=O)c1cc(NC)ccc1OC.CCN(C)C(=O)c1cc(C)cc(NC)c1.CNC(=O)c1cc(Cl)cc(NC)c1.CNC(=O)c1cc(F)cc(NC)c1.CNC(=O)c1cc(NC)cc(C(C)(C)C)c1.CNC(=O)c1cc(NC)cc(OC)c1.CNc1cc(C(=O)N(C)C)cc(C(C)(C)C)c1.CNc1cc(Cl)cc(C(=O)N(C)C)c1.CNc1cc(F)cc(C(=O)N(C)C)c1.CNc1cc(OC)cc(C(=O)N(C)C)c1.

What is the InChIKey of 3-tert-butyl-N,N-dimethyl-5-(methylamino)benzamide;3-tert-butyl-N-methyl-5-(methylamino)benzamide;3-tert-butyl-N-methyl-5-(methylamino)-N-propylbenzamide;3-chloro-N,N-dimethyl-5-(methylamino)benzamide;3-chloro-N-methyl-5-(methylamino)benzamide;N-ethyl-N,3-dimethyl-5-(methylamino)benzamide;3-fluoro-N,N-dimethyl-5-(methylamino)benzamide;3-fluoro-N-methyl-5-(methylamino)benzamide;3-methoxy-N,N-dimethyl-5-(methylamino)benzamide;3-methoxy-N-methyl-5-(methylamino)benzamide;2-methoxy-N-methyl-5-(methylamino)-N-propylbenzamide?

The InChIKey is NFJYYTMPQMSUTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O.C14H22N2O.C13H20N2O2.C13H20N2O.C12H18N2O.C11H16N2O2.C10H13ClN2O.C10H13FN2O.C10H14N2O2.C9H11ClN2O.C9H11FN2O/c1-7-8-18(6)15(19)12-9-13(16(2,3)4)11-14(10-12)17-5;1-14(2,3)11-7-10(13(17)16(5)6)8-12(9-11)15-4;1-5-8-15(3)13(16)11-9-10(14-2)6-7-12(11)17-4;1-13(2,3)10-6-9(12(16)15-5)7-11(8-10)14-4;1-5-14(4)12(15)10-6-9(2)7-11(8-10)13-3;1-12-9-5-8(11(14)13(2)3)6-10(7-9)15-4;2*1-12-9-5-7(4-8(11)6-9)10(14)13(2)3;1-11-8-4-7(10(13)12-2)5-9(6-8)14-3;2*1-11-8-4-6(9(13)12-2)3-7(10)5-8/h9-11,17H,7-8H2,1-6H3;7-9,15H,1-6H3;6-7,9,14H,5,8H2,1-4H3;6-8,14H,1-5H3,(H,15,16);6-8,13H,5H2,1-4H3;5-7,12H,1-4H3;2*4-6,12H,1-3H3;4-6,11H,1-3H3,(H,12,13);2*3-5,11H,1-2H3,(H,12,13).

What are the key properties of 3-tert-butyl-N,N-dimethyl-5-(methylamino)benzamide;3-tert-butyl-N-methyl-5-(methylamino)benzamide;3-tert-butyl-N-methyl-5-(methylamino)-N-propylbenzamide;3-chloro-N,N-dimethyl-5-(methylamino)benzamide;3-chloro-N-methyl-5-(methylamino)benzamide;N-ethyl-N,3-dimethyl-5-(methylamino)benzamide;3-fluoro-N,N-dimethyl-5-(methylamino)benzamide;3-fluoro-N-methyl-5-(methylamino)benzamide;3-methoxy-N,N-dimethyl-5-(methylamino)benzamide;3-methoxy-N-methyl-5-(methylamino)benzamide;2-methoxy-N-methyl-5-(methylamino)-N-propylbenzamide?

3-tert-butyl-N,N-dimethyl-5-(methylamino)benzamide;3-tert-butyl-N-methyl-5-(methylamino)benzamide;3-tert-butyl-N-methyl-5-(methylamino)-N-propylbenzamide;3-chloro-N,N-dimethyl-5-(methylamino)benzamide;3-chloro-N-methyl-5-(methylamino)benzamide;N-ethyl-N,3-dimethyl-5-(methylamino)benzamide;3-fluoro-N,N-dimethyl-5-(methylamino)benzamide;3-fluoro-N-methyl-5-(methylamino)benzamide;3-methoxy-N,N-dimethyl-5-(methylamino)benzamide;3-methoxy-N-methyl-5-(methylamino)benzamide;2-methoxy-N-methyl-5-(methylamino)-N-propylbenzamide has a molecular weight of 2351.91 g/mol, XLogP of 22.12, 30 rotatable bonds, 15 hydrogen bond donors, and 25 hydrogen bond acceptors.

Where does this data come from?

All data for 3-tert-butyl-N,N-dimethyl-5-(methylamino)benzamide;3-tert-butyl-N-methyl-5-(methylamino)benzamide;3-tert-butyl-N-methyl-5-(methylamino)-N-propylbenzamide;3-chloro-N,N-dimethyl-5-(methylamino)benzamide;3-chloro-N-methyl-5-(methylamino)benzamide;N-ethyl-N,3-dimethyl-5-(methylamino)benzamide;3-fluoro-N,N-dimethyl-5-(methylamino)benzamide;3-fluoro-N-methyl-5-(methylamino)benzamide;3-methoxy-N,N-dimethyl-5-(methylamino)benzamide;3-methoxy-N-methyl-5-(methylamino)benzamide;2-methoxy-N-methyl-5-(methylamino)-N-propylbenzamide is sourced from PubChem (CID 159765125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).