3-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-(3-methylbutyl)benzamide;3-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-(2-methylpropyl)benzamide;4-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-(2-methylpropyl)benzamide;3-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-pentylbenzamide;4-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-pentylbenzamide;4-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-propylbenzamide

C134H154F12N18O6 — CID 159808543

IUPAC3-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-(3-methylbutyl)benzamide;3-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-(2-methylpropyl)benzamide;4-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-(2-methylpropyl)benzamide;3-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-pentylbenzamide;4-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-pentylbenzamide;4-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-propylbenzamide
SMILESCCCCCN(Cc1nc2ccc(F)cc2n1CCC)C(=O)c1ccc(F)cc1.CCCCCN(Cc1nc2ccc(F)cc2n1CCC)C(=O)c1cccc(F)c1.CCCN(Cc1nc2ccc(F)cc2n1CCC)C(=O)c1ccc(F)cc1.CCCn1c(CN(CC(C)C)C(=O)c2ccc(F)cc2)nc2ccc(F)cc21.CCCn1c(CN(CC(C)C)C(=O)c2cccc(F)c2)nc2ccc(F)cc21.CCCn1c(CN(CCC(C)C)C(=O)c2cccc(F)c2)nc2ccc(F)cc21
InChIInChI=1S/3C23H27F2N3O.2C22H25F2N3O.C21H23F2N3O/c1-4-11-28-21-14-19(25)8-9-20(21)26-22(28)15-27(12-10-16(2)3)23(29)17-6-5-7-18(24)13-17;1-3-5-6-14-27(23(29)17-7-9-18(24)10-8-17)16-22-26-20-12-11-19(25)15-21(20)28(22)13-4-2;1-3-5-6-13-27(23(29)17-8-7-9-18(24)14-17)16-22-26-20-11-10-19(25)15-21(20)28(22)12-4-2;1-4-11-27-20-12-18(24)9-10-19(20)25-21(27)14-26(13-15(2)3)22(28)16-5-7-17(23)8-6-16;1-4-10-27-20-12-18(24)8-9-19(20)25-21(27)14-26(13-15(2)3)22(28)16-6-5-7-17(23)11-16;1-3-11-25(21(27)15-5-7-16(22)8-6-15)14-20-24-18-10-9-17(23)13-19(18)26(20)12-4-2/h5-9,13-14,16H,4,10-12,15H2,1-3H3;7-12,15H,3-6,13-14,16H2,1-2H3;7-11,14-15H,3-6,12-13,16H2,1-2H3;5-10,12,15H,4,11,13-14H2,1-3H3;5-9,11-12,15H,4,10,13-14H2,1-3H3;5-10,13H,3-4,11-12,14H2,1-2H3
InChIKeyNKSIPTFUZFFKGW-UHFFFAOYSA-N
MW2340.80 g/mol
LogP31.35
Rot. Bonds47

About 3-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-(3-methylbutyl)benzamide;3-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-(2-methylpropyl)benzamide;4-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-(2-methylpropyl)benzamide;3-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-pentylbenzamide;4-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-pentylbenzamide;4-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-propylbenzamide

3-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-(3-methylbutyl)benzamide;3-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-(2-methylpropyl)benzamide;4-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-(2-methylpropyl)benzamide;3-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-pentylbenzamide;4-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-pentylbenzamide;4-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-propylbenzamide (PubChem CID 159808543) has the molecular formula C134H154F12N18O6 and a molecular weight of 2340.80 g/mol. Its IUPAC name is 3-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-(3-methylbutyl)benzamide;3-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-(2-methylpropyl)benzamide;4-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-(2-methylpropyl)benzamide;3-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-pentylbenzamide;4-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-pentylbenzamide;4-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-propylbenzamide.

Molecular Properties

Compound Name3-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-(3-methylbutyl)benzamide;3-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-(2-methylpropyl)benzamide;4-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-(2-methylpropyl)benzamide;3-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-pentylbenzamide;4-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-pentylbenzamide;4-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-propylbenzamide
PubChem CID159808543
Molecular FormulaC134H154F12N18O6
Molecular Weight2340.80 g/mol
Exact Mass2339.21
IUPAC Name3-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-(3-methylbutyl)benzamide;3-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-(2-methylpropyl)benzamide;4-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-(2-methylpropyl)benzamide;3-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-pentylbenzamide;4-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-pentylbenzamide;4-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-propylbenzamide
SMILESCCCCCN(Cc1nc2ccc(F)cc2n1CCC)C(=O)c1ccc(F)cc1.CCCCCN(Cc1nc2ccc(F)cc2n1CCC)C(=O)c1cccc(F)c1.CCCN(Cc1nc2ccc(F)cc2n1CCC)C(=O)c1ccc(F)cc1.CCCn1c(CN(CC(C)C)C(=O)c2ccc(F)cc2)nc2ccc(F)cc21.CCCn1c(CN(CC(C)C)C(=O)c2cccc(F)c2)nc2ccc(F)cc21.CCCn1c(CN(CCC(C)C)C(=O)c2cccc(F)c2)nc2ccc(F)cc21
InChIInChI=1S/3C23H27F2N3O.2C22H25F2N3O.C21H23F2N3O/c1-4-11-28-21-14-19(25)8-9-20(21)26-22(28)15-27(12-10-16(2)3)23(29)17-6-5-7-18(24)13-17;1-3-5-6-14-27(23(29)17-7-9-18(24)10-8-17)16-22-26-20-12-11-19(25)15-21(20)28(22)13-4-2;1-3-5-6-13-27(23(29)17-8-7-9-18(24)14-17)16-22-26-20-11-10-19(25)15-21(20)28(22)12-4-2;1-4-11-27-20-12-18(24)9-10-19(20)25-21(27)14-26(13-15(2)3)22(28)16-5-7-17(23)8-6-16;1-4-10-27-20-12-18(24)8-9-19(20)25-21(27)14-26(13-15(2)3)22(28)16-6-5-7-17(23)11-16;1-3-11-25(21(27)15-5-7-16(22)8-6-15)14-20-24-18-10-9-17(23)13-19(18)26(20)12-4-2/h5-9,13-14,16H,4,10-12,15H2,1-3H3;7-12,15H,3-6,13-14,16H2,1-2H3;7-11,14-15H,3-6,12-13,16H2,1-2H3;5-10,12,15H,4,11,13-14H2,1-3H3;5-9,11-12,15H,4,10,13-14H2,1-3H3;5-10,13H,3-4,11-12,14H2,1-2H3
InChIKeyNKSIPTFUZFFKGW-UHFFFAOYSA-N
XLogP31.35
TPSA228.78 Ų
H-Bond Donors
H-Bond Acceptors18
Rotatable Bonds47
Heavy Atoms170
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002340.80
LogP ≤ 531.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1018

Computed Properties (RDKit)

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

Analyze 3-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-(3-methylbutyl)benzamide;3-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-(2-methylpropyl)benzamide;4-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-(2-methylpropyl)benzamide;3-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-pentylbenzamide;4-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-pentylbenzamide;4-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-propylbenzamide with MolForge

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Related Compounds

3-bromo-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-pentylbenzamide
CID 18732852
N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-3-methyl-N-pentylbenzamide
CID 18734004
N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-(2-methylpropyl)thiophene-3-carboxamide
CID 18734022
2,3,6-trifluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-(2-methylpropyl)benzamide
CID 18732433
3-fluoro-N-[[5-[(3-methylbutylamino)methyl]-1-propylbenzimidazol-2-yl]methyl]-N-propylbenzamide
CID 18733047
N-[[5-[[butyl(methyl)amino]methyl]-1-propylbenzimidazol-2-yl]methyl]-3-fluoro-N-propylbenzamide
CID 18733631
N-butyl-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-1,3-benzodioxole-5-carboxamide
CID 18734542
2,5-difluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-pentylbenzamide
CID 18732577
N-[(6-chloro-1-ethylbenzimidazol-2-yl)methyl]-3-fluoro-N-(2-methylpropyl)benzamide
CID 18733828
N-(2-methylpropyl)-N-[(1-propylbenzimidazol-2-yl)methyl]benzamide
CID 18734629
3-fluoro-N-[(5-fluoro-1-propylbenzimidazol-2-yl)methyl]-4-methyl-N-(2-methylpropyl)benzamide
CID 18733036
3-bromo-N-(2-methylpropyl)-N-[(1-propylbenzimidazol-2-yl)methyl]benzamide
CID 18732892

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-(3-methylbutyl)benzamide;3-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-(2-methylpropyl)benzamide;4-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-(2-methylpropyl)benzamide;3-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-pentylbenzamide;4-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-pentylbenzamide;4-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-propylbenzamide?
The IUPAC name of 3-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-(3-methylbutyl)benzamide;3-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-(2-methylpropyl)benzamide;4-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-(2-methylpropyl)benzamide;3-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-pentylbenzamide;4-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-pentylbenzamide;4-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-propylbenzamide (CID 159808543) is 3-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-(3-methylbutyl)benzamide;3-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-(2-methylpropyl)benzamide;4-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-(2-methylpropyl)benzamide;3-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-pentylbenzamide;4-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-pentylbenzamide;4-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-propylbenzamide.
What is the SMILES notation for 3-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-(3-methylbutyl)benzamide;3-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-(2-methylpropyl)benzamide;4-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-(2-methylpropyl)benzamide;3-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-pentylbenzamide;4-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-pentylbenzamide;4-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-propylbenzamide?
The canonical SMILES for 3-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-(3-methylbutyl)benzamide;3-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-(2-methylpropyl)benzamide;4-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-(2-methylpropyl)benzamide;3-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-pentylbenzamide;4-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-pentylbenzamide;4-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-propylbenzamide is CCCCCN(Cc1nc2ccc(F)cc2n1CCC)C(=O)c1ccc(F)cc1.CCCCCN(Cc1nc2ccc(F)cc2n1CCC)C(=O)c1cccc(F)c1.CCCN(Cc1nc2ccc(F)cc2n1CCC)C(=O)c1ccc(F)cc1.CCCn1c(CN(CC(C)C)C(=O)c2ccc(F)cc2)nc2ccc(F)cc21.CCCn1c(CN(CC(C)C)C(=O)c2cccc(F)c2)nc2ccc(F)cc21.CCCn1c(CN(CCC(C)C)C(=O)c2cccc(F)c2)nc2ccc(F)cc21.
What is the InChIKey of 3-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-(3-methylbutyl)benzamide;3-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-(2-methylpropyl)benzamide;4-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-(2-methylpropyl)benzamide;3-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-pentylbenzamide;4-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-pentylbenzamide;4-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-propylbenzamide?
The InChIKey is NKSIPTFUZFFKGW-UHFFFAOYSA-N. The full InChI is InChI=1S/3C23H27F2N3O.2C22H25F2N3O.C21H23F2N3O/c1-4-11-28-21-14-19(25)8-9-20(21)26-22(28)15-27(12-10-16(2)3)23(29)17-6-5-7-18(24)13-17;1-3-5-6-14-27(23(29)17-7-9-18(24)10-8-17)16-22-26-20-12-11-19(25)15-21(20)28(22)13-4-2;1-3-5-6-13-27(23(29)17-8-7-9-18(24)14-17)16-22-26-20-11-10-19(25)15-21(20)28(22)12-4-2;1-4-11-27-20-12-18(24)9-10-19(20)25-21(27)14-26(13-15(2)3)22(28)16-5-7-17(23)8-6-16;1-4-10-27-20-12-18(24)8-9-19(20)25-21(27)14-26(13-15(2)3)22(28)16-6-5-7-17(23)11-16;1-3-11-25(21(27)15-5-7-16(22)8-6-15)14-20-24-18-10-9-17(23)13-19(18)26(20)12-4-2/h5-9,13-14,16H,4,10-12,15H2,1-3H3;7-12,15H,3-6,13-14,16H2,1-2H3;7-11,14-15H,3-6,12-13,16H2,1-2H3;5-10,12,15H,4,11,13-14H2,1-3H3;5-9,11-12,15H,4,10,13-14H2,1-3H3;5-10,13H,3-4,11-12,14H2,1-2H3.
What are the key properties of 3-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-(3-methylbutyl)benzamide;3-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-(2-methylpropyl)benzamide;4-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-(2-methylpropyl)benzamide;3-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-pentylbenzamide;4-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-pentylbenzamide;4-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-propylbenzamide?
3-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-(3-methylbutyl)benzamide;3-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-(2-methylpropyl)benzamide;4-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-(2-methylpropyl)benzamide;3-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-pentylbenzamide;4-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-pentylbenzamide;4-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-propylbenzamide has a molecular weight of 2340.80 g/mol, XLogP of 31.35, 47 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-(3-methylbutyl)benzamide;3-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-(2-methylpropyl)benzamide;4-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-(2-methylpropyl)benzamide;3-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-pentylbenzamide;4-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-pentylbenzamide;4-fluoro-N-[(6-fluoro-1-propylbenzimidazol-2-yl)methyl]-N-propylbenzamide is sourced from PubChem (CID 159808543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).