4-[(5-fluoro-2-pyridinyl)methoxy]-1-(1,2,3,4-tetrahydropyrido[1,2-a]benzimidazol-7-yl)pyridin-2-one;methane;4-phenylmethoxy-1-(2-propan-2-yl-3,4-dihydro-1H-pyrazino[1,2-a]benzimidazol-8-yl)pyridin-2-one;4-phenylmethoxy-1-(1,2,3,4-tetrahydropyrido[1,2-a]benzimidazol-7-yl)pyridin-2-one;1-(1,2,3,4-tetrahydropyrido[1,2-a]benzimidazol-7-yl)-4-[4-(trifluoromethyl)phenyl]pyridin-2-one

C94H88F4N14O7 — CID 161072105

About 4-[(5-fluoro-2-pyridinyl)methoxy]-1-(1,2,3,4-tetrahydropyrido[1,2-a]benzimidazol-7-yl)pyridin-2-one;methane;4-phenylmethoxy-1-(2-propan-2-yl-3,4-dihydro-1H-pyrazino[1,2-a]benzimidazol-8-yl)pyridin-2-one;4-phenylmethoxy-1-(1,2,3,4-tetrahydropyrido[1,2-a]benzimidazol-7-yl)pyridin-2-one;1-(1,2,3,4-tetrahydropyrido[1,2-a]benzimidazol-7-yl)-4-[4-(trifluoromethyl)phenyl]pyridin-2-one

4-[(5-fluoro-2-pyridinyl)methoxy]-1-(1,2,3,4-tetrahydropyrido[1,2-a]benzimidazol-7-yl)pyridin-2-one;methane;4-phenylmethoxy-1-(2-propan-2-yl-3,4-dihydro-1H-pyrazino[1,2-a]benzimidazol-8-yl)pyridin-2-one;4-phenylmethoxy-1-(1,2,3,4-tetrahydropyrido[1,2-a]benzimidazol-7-yl)pyridin-2-one;1-(1,2,3,4-tetrahydropyrido[1,2-a]benzimidazol-7-yl)-4-[4-(trifluoromethyl)phenyl]pyridin-2-one (PubChem CID 161072105) has the molecular formula C94H88F4N14O7 and a molecular weight of 1601.82 g/mol. Its IUPAC name is 4-[(5-fluoro-2-pyridinyl)methoxy]-1-(1,2,3,4-tetrahydropyrido[1,2-a]benzimidazol-7-yl)pyridin-2-one;methane;4-phenylmethoxy-1-(2-propan-2-yl-3,4-dihydro-1H-pyrazino[1,2-a]benzimidazol-8-yl)pyridin-2-one;4-phenylmethoxy-1-(1,2,3,4-tetrahydropyrido[1,2-a]benzimidazol-7-yl)pyridin-2-one;1-(1,2,3,4-tetrahydropyrido[1,2-a]benzimidazol-7-yl)-4-[4-(trifluoromethyl)phenyl]pyridin-2-one.

Molecular Properties

• Compound Name: 4-[(5-fluoro-2-pyridinyl)methoxy]-1-(1,2,3,4-tetrahydropyrido[1,2-a]benzimidazol-7-yl)pyridin-2-one;methane;4-phenylmethoxy-1-(2-propan-2-yl-3,4-dihydro-1H-pyrazino[1,2-a]benzimidazol-8-yl)pyridin-2-one;4-phenylmethoxy-1-(1,2,3,4-tetrahydropyrido[1,2-a]benzimidazol-7-yl)pyridin-2-one;1-(1,2,3,4-tetrahydropyrido[1,2-a]benzimidazol-7-yl)-4-[4-(trifluoromethyl)phenyl]pyridin-2-one
• PubChem CID: 161072105
• Molecular Formula: C94H88F4N14O7
• Molecular Weight: 1601.82 g/mol
• Exact Mass: 1600.69
• IUPAC Name: 4-[(5-fluoro-2-pyridinyl)methoxy]-1-(1,2,3,4-tetrahydropyrido[1,2-a]benzimidazol-7-yl)pyridin-2-one;methane;4-phenylmethoxy-1-(2-propan-2-yl-3,4-dihydro-1H-pyrazino[1,2-a]benzimidazol-8-yl)pyridin-2-one;4-phenylmethoxy-1-(1,2,3,4-tetrahydropyrido[1,2-a]benzimidazol-7-yl)pyridin-2-one;1-(1,2,3,4-tetrahydropyrido[1,2-a]benzimidazol-7-yl)-4-[4-(trifluoromethyl)phenyl]pyridin-2-one
• SMILES: C.CC(C)N1CCn2c(nc3cc(-n4ccc(OCc5ccccc5)cc4=O)ccc32)C1.O=c1cc(-c2ccc(C(F)(F)F)cc2)ccn1-c1ccc2c(c1)nc1n2CCCC1.O=c1cc(OCc2ccc(F)cn2)ccn1-c1ccc2c(c1)nc1n2CCCC1.O=c1cc(OCc2ccccc2)ccn1-c1ccc2c(c1)nc1n2CCCC1
• InChI: InChI=1S/C25H26N4O2.C23H18F3N3O.C23H21N3O2.C22H19FN4O2.CH4/c1-18(2)27-12-13-29-23-9-8-20(14-22(23)26-24(29)16-27)28-11-10-21(15-25(28)30)31-17-19-6-4-3-5-7-19;24-23(25,26)17-6-4-15(5-7-17)16-10-12-28(22(30)13-16)18-8-9-20-19(14-18)27-21-3-1-2-11-29(20)21;27-23-15-19(28-16-17-6-2-1-3-7-17)11-13-25(23)18-9-10-21-20(14-18)24-22-8-4-5-12-26(21)22;23-15-4-5-16(24-13-15)14-29-18-8-10-26(22(28)12-18)17-6-7-20-19(11-17)25-21-3-1-2-9-27(20)21;/h3-11,14-15,18H,12-13,16-17H2,1-2H3;4-10,12-14H,1-3,11H2;1-3,6-7,9-11,13-15H,4-5,8,12,16H2;4-8,10-13H,1-3,9,14H2;1H4
• InChIKey: UEUHENLBKWINSM-UHFFFAOYSA-N
• XLogP: 17.57
• TPSA: 203.10 Ų
• H-Bond Acceptors: 21
• Rotatable Bonds: 15
• Heavy Atoms: 119
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1601.82
LogP ≤ 5	17.57
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	21

Frequently Asked Questions

What is the IUPAC name of 4-[(5-fluoro-2-pyridinyl)methoxy]-1-(1,2,3,4-tetrahydropyrido[1,2-a]benzimidazol-7-yl)pyridin-2-one;methane;4-phenylmethoxy-1-(2-propan-2-yl-3,4-dihydro-1H-pyrazino[1,2-a]benzimidazol-8-yl)pyridin-2-one;4-phenylmethoxy-1-(1,2,3,4-tetrahydropyrido[1,2-a]benzimidazol-7-yl)pyridin-2-one;1-(1,2,3,4-tetrahydropyrido[1,2-a]benzimidazol-7-yl)-4-[4-(trifluoromethyl)phenyl]pyridin-2-one?

The IUPAC name of 4-[(5-fluoro-2-pyridinyl)methoxy]-1-(1,2,3,4-tetrahydropyrido[1,2-a]benzimidazol-7-yl)pyridin-2-one;methane;4-phenylmethoxy-1-(2-propan-2-yl-3,4-dihydro-1H-pyrazino[1,2-a]benzimidazol-8-yl)pyridin-2-one;4-phenylmethoxy-1-(1,2,3,4-tetrahydropyrido[1,2-a]benzimidazol-7-yl)pyridin-2-one;1-(1,2,3,4-tetrahydropyrido[1,2-a]benzimidazol-7-yl)-4-[4-(trifluoromethyl)phenyl]pyridin-2-one (CID 161072105) is 4-[(5-fluoro-2-pyridinyl)methoxy]-1-(1,2,3,4-tetrahydropyrido[1,2-a]benzimidazol-7-yl)pyridin-2-one;methane;4-phenylmethoxy-1-(2-propan-2-yl-3,4-dihydro-1H-pyrazino[1,2-a]benzimidazol-8-yl)pyridin-2-one;4-phenylmethoxy-1-(1,2,3,4-tetrahydropyrido[1,2-a]benzimidazol-7-yl)pyridin-2-one;1-(1,2,3,4-tetrahydropyrido[1,2-a]benzimidazol-7-yl)-4-[4-(trifluoromethyl)phenyl]pyridin-2-one.

What is the SMILES notation for 4-[(5-fluoro-2-pyridinyl)methoxy]-1-(1,2,3,4-tetrahydropyrido[1,2-a]benzimidazol-7-yl)pyridin-2-one;methane;4-phenylmethoxy-1-(2-propan-2-yl-3,4-dihydro-1H-pyrazino[1,2-a]benzimidazol-8-yl)pyridin-2-one;4-phenylmethoxy-1-(1,2,3,4-tetrahydropyrido[1,2-a]benzimidazol-7-yl)pyridin-2-one;1-(1,2,3,4-tetrahydropyrido[1,2-a]benzimidazol-7-yl)-4-[4-(trifluoromethyl)phenyl]pyridin-2-one?

The canonical SMILES for 4-[(5-fluoro-2-pyridinyl)methoxy]-1-(1,2,3,4-tetrahydropyrido[1,2-a]benzimidazol-7-yl)pyridin-2-one;methane;4-phenylmethoxy-1-(2-propan-2-yl-3,4-dihydro-1H-pyrazino[1,2-a]benzimidazol-8-yl)pyridin-2-one;4-phenylmethoxy-1-(1,2,3,4-tetrahydropyrido[1,2-a]benzimidazol-7-yl)pyridin-2-one;1-(1,2,3,4-tetrahydropyrido[1,2-a]benzimidazol-7-yl)-4-[4-(trifluoromethyl)phenyl]pyridin-2-one is C.CC(C)N1CCn2c(nc3cc(-n4ccc(OCc5ccccc5)cc4=O)ccc32)C1.O=c1cc(-c2ccc(C(F)(F)F)cc2)ccn1-c1ccc2c(c1)nc1n2CCCC1.O=c1cc(OCc2ccc(F)cn2)ccn1-c1ccc2c(c1)nc1n2CCCC1.O=c1cc(OCc2ccccc2)ccn1-c1ccc2c(c1)nc1n2CCCC1.

What is the InChIKey of 4-[(5-fluoro-2-pyridinyl)methoxy]-1-(1,2,3,4-tetrahydropyrido[1,2-a]benzimidazol-7-yl)pyridin-2-one;methane;4-phenylmethoxy-1-(2-propan-2-yl-3,4-dihydro-1H-pyrazino[1,2-a]benzimidazol-8-yl)pyridin-2-one;4-phenylmethoxy-1-(1,2,3,4-tetrahydropyrido[1,2-a]benzimidazol-7-yl)pyridin-2-one;1-(1,2,3,4-tetrahydropyrido[1,2-a]benzimidazol-7-yl)-4-[4-(trifluoromethyl)phenyl]pyridin-2-one?

The InChIKey is UEUHENLBKWINSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26N4O2.C23H18F3N3O.C23H21N3O2.C22H19FN4O2.CH4/c1-18(2)27-12-13-29-23-9-8-20(14-22(23)26-24(29)16-27)28-11-10-21(15-25(28)30)31-17-19-6-4-3-5-7-19;24-23(25,26)17-6-4-15(5-7-17)16-10-12-28(22(30)13-16)18-8-9-20-19(14-18)27-21-3-1-2-11-29(20)21;27-23-15-19(28-16-17-6-2-1-3-7-17)11-13-25(23)18-9-10-21-20(14-18)24-22-8-4-5-12-26(21)22;23-15-4-5-16(24-13-15)14-29-18-8-10-26(22(28)12-18)17-6-7-20-19(11-17)25-21-3-1-2-9-27(20)21;/h3-11,14-15,18H,12-13,16-17H2,1-2H3;4-10,12-14H,1-3,11H2;1-3,6-7,9-11,13-15H,4-5,8,12,16H2;4-8,10-13H,1-3,9,14H2;1H4.

What are the key properties of 4-[(5-fluoro-2-pyridinyl)methoxy]-1-(1,2,3,4-tetrahydropyrido[1,2-a]benzimidazol-7-yl)pyridin-2-one;methane;4-phenylmethoxy-1-(2-propan-2-yl-3,4-dihydro-1H-pyrazino[1,2-a]benzimidazol-8-yl)pyridin-2-one;4-phenylmethoxy-1-(1,2,3,4-tetrahydropyrido[1,2-a]benzimidazol-7-yl)pyridin-2-one;1-(1,2,3,4-tetrahydropyrido[1,2-a]benzimidazol-7-yl)-4-[4-(trifluoromethyl)phenyl]pyridin-2-one?

4-[(5-fluoro-2-pyridinyl)methoxy]-1-(1,2,3,4-tetrahydropyrido[1,2-a]benzimidazol-7-yl)pyridin-2-one;methane;4-phenylmethoxy-1-(2-propan-2-yl-3,4-dihydro-1H-pyrazino[1,2-a]benzimidazol-8-yl)pyridin-2-one;4-phenylmethoxy-1-(1,2,3,4-tetrahydropyrido[1,2-a]benzimidazol-7-yl)pyridin-2-one;1-(1,2,3,4-tetrahydropyrido[1,2-a]benzimidazol-7-yl)-4-[4-(trifluoromethyl)phenyl]pyridin-2-one has a molecular weight of 1601.82 g/mol, XLogP of 17.57, 15 rotatable bonds, 0 hydrogen bond donors, and 21 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[(5-fluoro-2-pyridinyl)methoxy]-1-(1,2,3,4-tetrahydropyrido[1,2-a]benzimidazol-7-yl)pyridin-2-one;methane;4-phenylmethoxy-1-(2-propan-2-yl-3,4-dihydro-1H-pyrazino[1,2-a]benzimidazol-8-yl)pyridin-2-one;4-phenylmethoxy-1-(1,2,3,4-tetrahydropyrido[1,2-a]benzimidazol-7-yl)pyridin-2-one;1-(1,2,3,4-tetrahydropyrido[1,2-a]benzimidazol-7-yl)-4-[4-(trifluoromethyl)phenyl]pyridin-2-one is sourced from PubChem (CID 161072105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).