3-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-4-methyl-N-(3-methylbutyl)benzamide;5-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-2-methyl-N-(3-methylbutyl)benzamide;3-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-4-methyl-N-(2-methylpropyl)benzamide;5-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-2-methyl-N-(2-methylpropyl)benzamide;5-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-2-methyl-N-pentylbenzamide;N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-3-methoxy-N-(3-methylbutyl)benzamide

C142H171F11N18O7 — CID 158219251

IUPAC3-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-4-methyl-N-(3-methylbutyl)benzamide;5-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-2-methyl-N-(3-methylbutyl)benzamide;3-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-4-methyl-N-(2-methylpropyl)benzamide;5-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-2-methyl-N-(2-methylpropyl)benzamide;5-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-2-methyl-N-pentylbenzamide;N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-3-methoxy-N-(3-methylbutyl)benzamide
SMILESCCCCCN(Cc1nc2cc(F)ccc2n1CCC)C(=O)c1cc(F)ccc1C.CCCn1c(CN(CC(C)C)C(=O)c2cc(F)ccc2C)nc2cc(F)ccc21.CCCn1c(CN(CC(C)C)C(=O)c2ccc(C)c(F)c2)nc2cc(F)ccc21.CCCn1c(CN(CCC(C)C)C(=O)c2cc(F)ccc2C)nc2cc(F)ccc21.CCCn1c(CN(CCC(C)C)C(=O)c2ccc(C)c(F)c2)nc2cc(F)ccc21.CCCn1c(CN(CCC(C)C)C(=O)c2cccc(OC)c2)nc2cc(F)ccc21
InChIInChI=1S/3C24H29F2N3O.C24H30FN3O2.2C23H27F2N3O/c1-5-11-29-22-9-8-19(26)14-21(22)27-23(29)15-28(12-10-16(2)3)24(30)20-13-18(25)7-6-17(20)4;1-5-11-29-22-9-8-19(25)14-21(22)27-23(29)15-28(12-10-16(2)3)24(30)18-7-6-17(4)20(26)13-18;1-4-6-7-13-28(24(30)20-14-18(25)9-8-17(20)3)16-23-27-21-15-19(26)10-11-22(21)29(23)12-5-2;1-5-12-28-22-10-9-19(25)15-21(22)26-23(28)16-27(13-11-17(2)3)24(29)18-7-6-8-20(14-18)30-4;1-5-10-28-21-9-8-18(25)12-20(21)26-22(28)14-27(13-15(2)3)23(29)19-11-17(24)7-6-16(19)4;1-5-10-28-21-9-8-18(24)12-20(21)26-22(28)14-27(13-15(2)3)23(29)17-7-6-16(4)19(25)11-17/h2*6-9,13-14,16H,5,10-12,15H2,1-4H3;8-11,14-15H,4-7,12-13,16H2,1-3H3;6-10,14-15,17H,5,11-13,16H2,1-4H3;2*6-9,11-12,15H,5,10,13-14H2,1-4H3
InChIKeyGDARISYIBCLCDX-UHFFFAOYSA-N
MW2451.03 g/mol
LogP33.25
Rot. Bonds48

About 3-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-4-methyl-N-(3-methylbutyl)benzamide;5-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-2-methyl-N-(3-methylbutyl)benzamide;3-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-4-methyl-N-(2-methylpropyl)benzamide;5-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-2-methyl-N-(2-methylpropyl)benzamide;5-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-2-methyl-N-pentylbenzamide;N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-3-methoxy-N-(3-methylbutyl)benzamide

3-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-4-methyl-N-(3-methylbutyl)benzamide;5-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-2-methyl-N-(3-methylbutyl)benzamide;3-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-4-methyl-N-(2-methylpropyl)benzamide;5-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-2-methyl-N-(2-methylpropyl)benzamide;5-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-2-methyl-N-pentylbenzamide;N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-3-methoxy-N-(3-methylbutyl)benzamide (PubChem CID 158219251) has the molecular formula C142H171F11N18O7 and a molecular weight of 2451.03 g/mol. Its IUPAC name is 3-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-4-methyl-N-(3-methylbutyl)benzamide;5-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-2-methyl-N-(3-methylbutyl)benzamide;3-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-4-methyl-N-(2-methylpropyl)benzamide;5-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-2-methyl-N-(2-methylpropyl)benzamide;5-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-2-methyl-N-pentylbenzamide;N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-3-methoxy-N-(3-methylbutyl)benzamide.

Molecular Properties

Compound Name3-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-4-methyl-N-(3-methylbutyl)benzamide;5-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-2-methyl-N-(3-methylbutyl)benzamide;3-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-4-methyl-N-(2-methylpropyl)benzamide;5-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-2-methyl-N-(2-methylpropyl)benzamide;5-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-2-methyl-N-pentylbenzamide;N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-3-methoxy-N-(3-methylbutyl)benzamide
PubChem CID158219251
Molecular FormulaC142H171F11N18O7
Molecular Weight2451.03 g/mol
Exact Mass2449.34
IUPAC Name3-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-4-methyl-N-(3-methylbutyl)benzamide;5-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-2-methyl-N-(3-methylbutyl)benzamide;3-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-4-methyl-N-(2-methylpropyl)benzamide;5-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-2-methyl-N-(2-methylpropyl)benzamide;5-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-2-methyl-N-pentylbenzamide;N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-3-methoxy-N-(3-methylbutyl)benzamide
SMILESCCCCCN(Cc1nc2cc(F)ccc2n1CCC)C(=O)c1cc(F)ccc1C.CCCn1c(CN(CC(C)C)C(=O)c2cc(F)ccc2C)nc2cc(F)ccc21.CCCn1c(CN(CC(C)C)C(=O)c2ccc(C)c(F)c2)nc2cc(F)ccc21.CCCn1c(CN(CCC(C)C)C(=O)c2cc(F)ccc2C)nc2cc(F)ccc21.CCCn1c(CN(CCC(C)C)C(=O)c2ccc(C)c(F)c2)nc2cc(F)ccc21.CCCn1c(CN(CCC(C)C)C(=O)c2cccc(OC)c2)nc2cc(F)ccc21
InChIInChI=1S/3C24H29F2N3O.C24H30FN3O2.2C23H27F2N3O/c1-5-11-29-22-9-8-19(26)14-21(22)27-23(29)15-28(12-10-16(2)3)24(30)20-13-18(25)7-6-17(20)4;1-5-11-29-22-9-8-19(25)14-21(22)27-23(29)15-28(12-10-16(2)3)24(30)18-7-6-17(4)20(26)13-18;1-4-6-7-13-28(24(30)20-14-18(25)9-8-17(20)3)16-23-27-21-15-19(26)10-11-22(21)29(23)12-5-2;1-5-12-28-22-10-9-19(25)15-21(22)26-23(28)16-27(13-11-17(2)3)24(29)18-7-6-8-20(14-18)30-4;1-5-10-28-21-9-8-18(25)12-20(21)26-22(28)14-27(13-15(2)3)23(29)19-11-17(24)7-6-16(19)4;1-5-10-28-21-9-8-18(24)12-20(21)26-22(28)14-27(13-15(2)3)23(29)17-7-6-16(4)19(25)11-17/h2*6-9,13-14,16H,5,10-12,15H2,1-4H3;8-11,14-15H,4-7,12-13,16H2,1-3H3;6-10,14-15,17H,5,11-13,16H2,1-4H3;2*6-9,11-12,15H,5,10,13-14H2,1-4H3
InChIKeyGDARISYIBCLCDX-UHFFFAOYSA-N
XLogP33.25
TPSA238.01 Ų
H-Bond Donors
H-Bond Acceptors19
Rotatable Bonds48
Heavy Atoms178
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002451.03
LogP ≤ 533.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1019

Computed Properties (RDKit)

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

Analyze 3-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-4-methyl-N-(3-methylbutyl)benzamide;5-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-2-methyl-N-(3-methylbutyl)benzamide;3-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-4-methyl-N-(2-methylpropyl)benzamide;5-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-2-methyl-N-(2-methylpropyl)benzamide;5-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-2-methyl-N-pentylbenzamide;N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-3-methoxy-N-(3-methylbutyl)benzamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-4-methyl-N-(3-methylbutyl)benzamide;5-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-2-methyl-N-(3-methylbutyl)benzamide;3-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-4-methyl-N-(2-methylpropyl)benzamide;5-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-2-methyl-N-(2-methylpropyl)benzamide;5-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-2-methyl-N-pentylbenzamide;N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-3-methoxy-N-(3-methylbutyl)benzamide?
The IUPAC name of 3-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-4-methyl-N-(3-methylbutyl)benzamide;5-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-2-methyl-N-(3-methylbutyl)benzamide;3-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-4-methyl-N-(2-methylpropyl)benzamide;5-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-2-methyl-N-(2-methylpropyl)benzamide;5-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-2-methyl-N-pentylbenzamide;N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-3-methoxy-N-(3-methylbutyl)benzamide (CID 158219251) is 3-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-4-methyl-N-(3-methylbutyl)benzamide;5-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-2-methyl-N-(3-methylbutyl)benzamide;3-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-4-methyl-N-(2-methylpropyl)benzamide;5-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-2-methyl-N-(2-methylpropyl)benzamide;5-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-2-methyl-N-pentylbenzamide;N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-3-methoxy-N-(3-methylbutyl)benzamide.
What is the SMILES notation for 3-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-4-methyl-N-(3-methylbutyl)benzamide;5-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-2-methyl-N-(3-methylbutyl)benzamide;3-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-4-methyl-N-(2-methylpropyl)benzamide;5-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-2-methyl-N-(2-methylpropyl)benzamide;5-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-2-methyl-N-pentylbenzamide;N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-3-methoxy-N-(3-methylbutyl)benzamide?
The canonical SMILES for 3-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-4-methyl-N-(3-methylbutyl)benzamide;5-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-2-methyl-N-(3-methylbutyl)benzamide;3-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-4-methyl-N-(2-methylpropyl)benzamide;5-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-2-methyl-N-(2-methylpropyl)benzamide;5-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-2-methyl-N-pentylbenzamide;N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-3-methoxy-N-(3-methylbutyl)benzamide is CCCCCN(Cc1nc2cc(F)ccc2n1CCC)C(=O)c1cc(F)ccc1C.CCCn1c(CN(CC(C)C)C(=O)c2cc(F)ccc2C)nc2cc(F)ccc21.CCCn1c(CN(CC(C)C)C(=O)c2ccc(C)c(F)c2)nc2cc(F)ccc21.CCCn1c(CN(CCC(C)C)C(=O)c2cc(F)ccc2C)nc2cc(F)ccc21.CCCn1c(CN(CCC(C)C)C(=O)c2ccc(C)c(F)c2)nc2cc(F)ccc21.CCCn1c(CN(CCC(C)C)C(=O)c2cccc(OC)c2)nc2cc(F)ccc21.
What is the InChIKey of 3-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-4-methyl-N-(3-methylbutyl)benzamide;5-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-2-methyl-N-(3-methylbutyl)benzamide;3-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-4-methyl-N-(2-methylpropyl)benzamide;5-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-2-methyl-N-(2-methylpropyl)benzamide;5-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-2-methyl-N-pentylbenzamide;N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-3-methoxy-N-(3-methylbutyl)benzamide?
The InChIKey is GDARISYIBCLCDX-UHFFFAOYSA-N. The full InChI is InChI=1S/3C24H29F2N3O.C24H30FN3O2.2C23H27F2N3O/c1-5-11-29-22-9-8-19(26)14-21(22)27-23(29)15-28(12-10-16(2)3)24(30)20-13-18(25)7-6-17(20)4;1-5-11-29-22-9-8-19(25)14-21(22)27-23(29)15-28(12-10-16(2)3)24(30)18-7-6-17(4)20(26)13-18;1-4-6-7-13-28(24(30)20-14-18(25)9-8-17(20)3)16-23-27-21-15-19(26)10-11-22(21)29(23)12-5-2;1-5-12-28-22-10-9-19(25)15-21(22)26-23(28)16-27(13-11-17(2)3)24(29)18-7-6-8-20(14-18)30-4;1-5-10-28-21-9-8-18(25)12-20(21)26-22(28)14-27(13-15(2)3)23(29)19-11-17(24)7-6-16(19)4;1-5-10-28-21-9-8-18(24)12-20(21)26-22(28)14-27(13-15(2)3)23(29)17-7-6-16(4)19(25)11-17/h2*6-9,13-14,16H,5,10-12,15H2,1-4H3;8-11,14-15H,4-7,12-13,16H2,1-3H3;6-10,14-15,17H,5,11-13,16H2,1-4H3;2*6-9,11-12,15H,5,10,13-14H2,1-4H3.
What are the key properties of 3-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-4-methyl-N-(3-methylbutyl)benzamide;5-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-2-methyl-N-(3-methylbutyl)benzamide;3-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-4-methyl-N-(2-methylpropyl)benzamide;5-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-2-methyl-N-(2-methylpropyl)benzamide;5-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-2-methyl-N-pentylbenzamide;N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-3-methoxy-N-(3-methylbutyl)benzamide?
3-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-4-methyl-N-(3-methylbutyl)benzamide;5-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-2-methyl-N-(3-methylbutyl)benzamide;3-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-4-methyl-N-(2-methylpropyl)benzamide;5-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-2-methyl-N-(2-methylpropyl)benzamide;5-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-2-methyl-N-pentylbenzamide;N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-3-methoxy-N-(3-methylbutyl)benzamide has a molecular weight of 2451.03 g/mol, XLogP of 33.25, 48 rotatable bonds, 0 hydrogen bond donors, and 19 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-4-methyl-N-(3-methylbutyl)benzamide;5-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-2-methyl-N-(3-methylbutyl)benzamide;3-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-4-methyl-N-(2-methylpropyl)benzamide;5-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-2-methyl-N-(2-methylpropyl)benzamide;5-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-2-methyl-N-pentylbenzamide;N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-3-methoxy-N-(3-methylbutyl)benzamide is sourced from PubChem (CID 158219251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).