3-(2-tert-butylcyclopentyl)-5-fluoropyridine;2-(1-tert-butylpyrrolidin-2-yl)pyridine;2-(2-chloro-5-fluorophenyl)-1-propan-2-ylpyrrolidine;2-(3-chloro-5-fluorophenyl)-1-propan-2-ylpyrrolidine;5-(2,5-difluorophenyl)-1,2,2-trimethylpyrrolidine;2-[3-fluoro-5-(2-methoxyethoxy)phenyl]-1-methylpyrrolidine;2-(5-fluoro-2-methoxyphenyl)-1-propan-2-ylpyrrolidine;4-[2-[3-fluoro-5-(1-methylpyrrolidin-2-yl)phenoxy]ethyl]morpholine;[5-fluoro-3-(1-methylpyrrolidin-2-yl)-2-pyridinyl]methanol;2-[5-fluoro-2-(trifluoromethyl)phenyl]-1-propan-2-ylpyrrolidine

C136H188Cl2F13N13O6 — CID 160984211

About 3-(2-tert-butylcyclopentyl)-5-fluoropyridine;2-(1-tert-butylpyrrolidin-2-yl)pyridine;2-(2-chloro-5-fluorophenyl)-1-propan-2-ylpyrrolidine;2-(3-chloro-5-fluorophenyl)-1-propan-2-ylpyrrolidine;5-(2,5-difluorophenyl)-1,2,2-trimethylpyrrolidine;2-[3-fluoro-5-(2-methoxyethoxy)phenyl]-1-methylpyrrolidine;2-(5-fluoro-2-methoxyphenyl)-1-propan-2-ylpyrrolidine;4-[2-[3-fluoro-5-(1-methylpyrrolidin-2-yl)phenoxy]ethyl]morpholine;[5-fluoro-3-(1-methylpyrrolidin-2-yl)-2-pyridinyl]methanol;2-[5-fluoro-2-(trifluoromethyl)phenyl]-1-propan-2-ylpyrrolidine

3-(2-tert-butylcyclopentyl)-5-fluoropyridine;2-(1-tert-butylpyrrolidin-2-yl)pyridine;2-(2-chloro-5-fluorophenyl)-1-propan-2-ylpyrrolidine;2-(3-chloro-5-fluorophenyl)-1-propan-2-ylpyrrolidine;5-(2,5-difluorophenyl)-1,2,2-trimethylpyrrolidine;2-[3-fluoro-5-(2-methoxyethoxy)phenyl]-1-methylpyrrolidine;2-(5-fluoro-2-methoxyphenyl)-1-propan-2-ylpyrrolidine;4-[2-[3-fluoro-5-(1-methylpyrrolidin-2-yl)phenoxy]ethyl]morpholine;[5-fluoro-3-(1-methylpyrrolidin-2-yl)-2-pyridinyl]methanol;2-[5-fluoro-2-(trifluoromethyl)phenyl]-1-propan-2-ylpyrrolidine (PubChem CID 160984211) has the molecular formula C136H188Cl2F13N13O6 and a molecular weight of 2418.96 g/mol. Its IUPAC name is 3-(2-tert-butylcyclopentyl)-5-fluoropyridine;2-(1-tert-butylpyrrolidin-2-yl)pyridine;2-(2-chloro-5-fluorophenyl)-1-propan-2-ylpyrrolidine;2-(3-chloro-5-fluorophenyl)-1-propan-2-ylpyrrolidine;5-(2,5-difluorophenyl)-1,2,2-trimethylpyrrolidine;2-[3-fluoro-5-(2-methoxyethoxy)phenyl]-1-methylpyrrolidine;2-(5-fluoro-2-methoxyphenyl)-1-propan-2-ylpyrrolidine;4-[2-[3-fluoro-5-(1-methylpyrrolidin-2-yl)phenoxy]ethyl]morpholine;[5-fluoro-3-(1-methylpyrrolidin-2-yl)-2-pyridinyl]methanol;2-[5-fluoro-2-(trifluoromethyl)phenyl]-1-propan-2-ylpyrrolidine.

Molecular Properties

• Compound Name: 3-(2-tert-butylcyclopentyl)-5-fluoropyridine;2-(1-tert-butylpyrrolidin-2-yl)pyridine;2-(2-chloro-5-fluorophenyl)-1-propan-2-ylpyrrolidine;2-(3-chloro-5-fluorophenyl)-1-propan-2-ylpyrrolidine;5-(2,5-difluorophenyl)-1,2,2-trimethylpyrrolidine;2-[3-fluoro-5-(2-methoxyethoxy)phenyl]-1-methylpyrrolidine;2-(5-fluoro-2-methoxyphenyl)-1-propan-2-ylpyrrolidine;4-[2-[3-fluoro-5-(1-methylpyrrolidin-2-yl)phenoxy]ethyl]morpholine;[5-fluoro-3-(1-methylpyrrolidin-2-yl)-2-pyridinyl]methanol;2-[5-fluoro-2-(trifluoromethyl)phenyl]-1-propan-2-ylpyrrolidine
• PubChem CID: 160984211
• Molecular Formula: C136H188Cl2F13N13O6
• Molecular Weight: 2418.96 g/mol
• Exact Mass: 2416.40
• IUPAC Name: 3-(2-tert-butylcyclopentyl)-5-fluoropyridine;2-(1-tert-butylpyrrolidin-2-yl)pyridine;2-(2-chloro-5-fluorophenyl)-1-propan-2-ylpyrrolidine;2-(3-chloro-5-fluorophenyl)-1-propan-2-ylpyrrolidine;5-(2,5-difluorophenyl)-1,2,2-trimethylpyrrolidine;2-[3-fluoro-5-(2-methoxyethoxy)phenyl]-1-methylpyrrolidine;2-(5-fluoro-2-methoxyphenyl)-1-propan-2-ylpyrrolidine;4-[2-[3-fluoro-5-(1-methylpyrrolidin-2-yl)phenoxy]ethyl]morpholine;[5-fluoro-3-(1-methylpyrrolidin-2-yl)-2-pyridinyl]methanol;2-[5-fluoro-2-(trifluoromethyl)phenyl]-1-propan-2-ylpyrrolidine
• SMILES: CC(C)(C)C1CCCC1c1cncc(F)c1.CC(C)(C)N1CCCC1c1ccccn1.CC(C)N1CCCC1c1cc(F)cc(Cl)c1.CC(C)N1CCCC1c1cc(F)ccc1C(F)(F)F.CC(C)N1CCCC1c1cc(F)ccc1Cl.CN1C(c2cc(F)ccc2F)CCC1(C)C.CN1CCCC1c1cc(F)cc(OCCN2CCOCC2)c1.CN1CCCC1c1cc(F)cnc1CO.COCCOc1cc(F)cc(C2CCCN2C)c1.COc1ccc(F)cc1C1CCCN1C(C)C
• InChI: InChI=1S/C17H25FN2O2.C14H17F4N.C14H20FNO2.C14H20FNO.C14H20FN.2C13H17ClFN.C13H17F2N.C13H20N2.C11H15FN2O/c1-19-4-2-3-17(19)14-11-15(18)13-16(12-14)22-10-7-20-5-8-21-9-6-20;1-9(2)19-7-3-4-13(19)11-8-10(15)5-6-12(11)14(16,17)18;1-16-5-3-4-14(16)11-8-12(15)10-13(9-11)18-7-6-17-2;1-10(2)16-8-4-5-13(16)12-9-11(15)6-7-14(12)17-3;1-14(2,3)13-6-4-5-12(13)10-7-11(15)9-16-8-10;1-9(2)16-7-3-4-13(16)11-8-10(15)5-6-12(11)14;1-9(2)16-5-3-4-13(16)10-6-11(14)8-12(15)7-10;1-13(2)7-6-12(16(13)3)10-8-9(14)4-5-11(10)15;1-13(2,3)15-10-6-8-12(15)11-7-4-5-9-14-11;1-14-4-2-3-11(14)9-5-8(12)6-13-10(9)7-15/h11-13,17H,2-10H2,1H3;5-6,8-9,13H,3-4,7H2,1-2H3;8-10,14H,3-7H2,1-2H3;6-7,9-10,13H,4-5,8H2,1-3H3;7-9,12-13H,4-6H2,1-3H3;5-6,8-9,13H,3-4,7H2,1-2H3;6-9,13H,3-5H2,1-2H3;4-5,8,12H,6-7H2,1-3H3;4-5,7,9,12H,6,8,10H2,1-3H3;5-6,11,15H,2-4,7H2,1H3
• InChIKey: SZXGUFYBFZLOCV-UHFFFAOYSA-N
• XLogP: 32.90
• TPSA: 137.45 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 19
• Rotatable Bonds: 24
• Heavy Atoms: 170
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2418.96
LogP ≤ 5	32.90
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	19

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 3-(2-tert-butylcyclopentyl)-5-fluoropyridine;2-(1-tert-butylpyrrolidin-2-yl)pyridine;2-(2-chloro-5-fluorophenyl)-1-propan-2-ylpyrrolidine;2-(3-chloro-5-fluorophenyl)-1-propan-2-ylpyrrolidine;5-(2,5-difluorophenyl)-1,2,2-trimethylpyrrolidine;2-[3-fluoro-5-(2-methoxyethoxy)phenyl]-1-methylpyrrolidine;2-(5-fluoro-2-methoxyphenyl)-1-propan-2-ylpyrrolidine;4-[2-[3-fluoro-5-(1-methylpyrrolidin-2-yl)phenoxy]ethyl]morpholine;[5-fluoro-3-(1-methylpyrrolidin-2-yl)-2-pyridinyl]methanol;2-[5-fluoro-2-(trifluoromethyl)phenyl]-1-propan-2-ylpyrrolidine?

The IUPAC name of 3-(2-tert-butylcyclopentyl)-5-fluoropyridine;2-(1-tert-butylpyrrolidin-2-yl)pyridine;2-(2-chloro-5-fluorophenyl)-1-propan-2-ylpyrrolidine;2-(3-chloro-5-fluorophenyl)-1-propan-2-ylpyrrolidine;5-(2,5-difluorophenyl)-1,2,2-trimethylpyrrolidine;2-[3-fluoro-5-(2-methoxyethoxy)phenyl]-1-methylpyrrolidine;2-(5-fluoro-2-methoxyphenyl)-1-propan-2-ylpyrrolidine;4-[2-[3-fluoro-5-(1-methylpyrrolidin-2-yl)phenoxy]ethyl]morpholine;[5-fluoro-3-(1-methylpyrrolidin-2-yl)-2-pyridinyl]methanol;2-[5-fluoro-2-(trifluoromethyl)phenyl]-1-propan-2-ylpyrrolidine (CID 160984211) is 3-(2-tert-butylcyclopentyl)-5-fluoropyridine;2-(1-tert-butylpyrrolidin-2-yl)pyridine;2-(2-chloro-5-fluorophenyl)-1-propan-2-ylpyrrolidine;2-(3-chloro-5-fluorophenyl)-1-propan-2-ylpyrrolidine;5-(2,5-difluorophenyl)-1,2,2-trimethylpyrrolidine;2-[3-fluoro-5-(2-methoxyethoxy)phenyl]-1-methylpyrrolidine;2-(5-fluoro-2-methoxyphenyl)-1-propan-2-ylpyrrolidine;4-[2-[3-fluoro-5-(1-methylpyrrolidin-2-yl)phenoxy]ethyl]morpholine;[5-fluoro-3-(1-methylpyrrolidin-2-yl)-2-pyridinyl]methanol;2-[5-fluoro-2-(trifluoromethyl)phenyl]-1-propan-2-ylpyrrolidine.

What is the SMILES notation for 3-(2-tert-butylcyclopentyl)-5-fluoropyridine;2-(1-tert-butylpyrrolidin-2-yl)pyridine;2-(2-chloro-5-fluorophenyl)-1-propan-2-ylpyrrolidine;2-(3-chloro-5-fluorophenyl)-1-propan-2-ylpyrrolidine;5-(2,5-difluorophenyl)-1,2,2-trimethylpyrrolidine;2-[3-fluoro-5-(2-methoxyethoxy)phenyl]-1-methylpyrrolidine;2-(5-fluoro-2-methoxyphenyl)-1-propan-2-ylpyrrolidine;4-[2-[3-fluoro-5-(1-methylpyrrolidin-2-yl)phenoxy]ethyl]morpholine;[5-fluoro-3-(1-methylpyrrolidin-2-yl)-2-pyridinyl]methanol;2-[5-fluoro-2-(trifluoromethyl)phenyl]-1-propan-2-ylpyrrolidine?

The canonical SMILES for 3-(2-tert-butylcyclopentyl)-5-fluoropyridine;2-(1-tert-butylpyrrolidin-2-yl)pyridine;2-(2-chloro-5-fluorophenyl)-1-propan-2-ylpyrrolidine;2-(3-chloro-5-fluorophenyl)-1-propan-2-ylpyrrolidine;5-(2,5-difluorophenyl)-1,2,2-trimethylpyrrolidine;2-[3-fluoro-5-(2-methoxyethoxy)phenyl]-1-methylpyrrolidine;2-(5-fluoro-2-methoxyphenyl)-1-propan-2-ylpyrrolidine;4-[2-[3-fluoro-5-(1-methylpyrrolidin-2-yl)phenoxy]ethyl]morpholine;[5-fluoro-3-(1-methylpyrrolidin-2-yl)-2-pyridinyl]methanol;2-[5-fluoro-2-(trifluoromethyl)phenyl]-1-propan-2-ylpyrrolidine is CC(C)(C)C1CCCC1c1cncc(F)c1.CC(C)(C)N1CCCC1c1ccccn1.CC(C)N1CCCC1c1cc(F)cc(Cl)c1.CC(C)N1CCCC1c1cc(F)ccc1C(F)(F)F.CC(C)N1CCCC1c1cc(F)ccc1Cl.CN1C(c2cc(F)ccc2F)CCC1(C)C.CN1CCCC1c1cc(F)cc(OCCN2CCOCC2)c1.CN1CCCC1c1cc(F)cnc1CO.COCCOc1cc(F)cc(C2CCCN2C)c1.COc1ccc(F)cc1C1CCCN1C(C)C.

What is the InChIKey of 3-(2-tert-butylcyclopentyl)-5-fluoropyridine;2-(1-tert-butylpyrrolidin-2-yl)pyridine;2-(2-chloro-5-fluorophenyl)-1-propan-2-ylpyrrolidine;2-(3-chloro-5-fluorophenyl)-1-propan-2-ylpyrrolidine;5-(2,5-difluorophenyl)-1,2,2-trimethylpyrrolidine;2-[3-fluoro-5-(2-methoxyethoxy)phenyl]-1-methylpyrrolidine;2-(5-fluoro-2-methoxyphenyl)-1-propan-2-ylpyrrolidine;4-[2-[3-fluoro-5-(1-methylpyrrolidin-2-yl)phenoxy]ethyl]morpholine;[5-fluoro-3-(1-methylpyrrolidin-2-yl)-2-pyridinyl]methanol;2-[5-fluoro-2-(trifluoromethyl)phenyl]-1-propan-2-ylpyrrolidine?

The InChIKey is SZXGUFYBFZLOCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25FN2O2.C14H17F4N.C14H20FNO2.C14H20FNO.C14H20FN.2C13H17ClFN.C13H17F2N.C13H20N2.C11H15FN2O/c1-19-4-2-3-17(19)14-11-15(18)13-16(12-14)22-10-7-20-5-8-21-9-6-20;1-9(2)19-7-3-4-13(19)11-8-10(15)5-6-12(11)14(16,17)18;1-16-5-3-4-14(16)11-8-12(15)10-13(9-11)18-7-6-17-2;1-10(2)16-8-4-5-13(16)12-9-11(15)6-7-14(12)17-3;1-14(2,3)13-6-4-5-12(13)10-7-11(15)9-16-8-10;1-9(2)16-7-3-4-13(16)11-8-10(15)5-6-12(11)14;1-9(2)16-5-3-4-13(16)10-6-11(14)8-12(15)7-10;1-13(2)7-6-12(16(13)3)10-8-9(14)4-5-11(10)15;1-13(2,3)15-10-6-8-12(15)11-7-4-5-9-14-11;1-14-4-2-3-11(14)9-5-8(12)6-13-10(9)7-15/h11-13,17H,2-10H2,1H3;5-6,8-9,13H,3-4,7H2,1-2H3;8-10,14H,3-7H2,1-2H3;6-7,9-10,13H,4-5,8H2,1-3H3;7-9,12-13H,4-6H2,1-3H3;5-6,8-9,13H,3-4,7H2,1-2H3;6-9,13H,3-5H2,1-2H3;4-5,8,12H,6-7H2,1-3H3;4-5,7,9,12H,6,8,10H2,1-3H3;5-6,11,15H,2-4,7H2,1H3.

What are the key properties of 3-(2-tert-butylcyclopentyl)-5-fluoropyridine;2-(1-tert-butylpyrrolidin-2-yl)pyridine;2-(2-chloro-5-fluorophenyl)-1-propan-2-ylpyrrolidine;2-(3-chloro-5-fluorophenyl)-1-propan-2-ylpyrrolidine;5-(2,5-difluorophenyl)-1,2,2-trimethylpyrrolidine;2-[3-fluoro-5-(2-methoxyethoxy)phenyl]-1-methylpyrrolidine;2-(5-fluoro-2-methoxyphenyl)-1-propan-2-ylpyrrolidine;4-[2-[3-fluoro-5-(1-methylpyrrolidin-2-yl)phenoxy]ethyl]morpholine;[5-fluoro-3-(1-methylpyrrolidin-2-yl)-2-pyridinyl]methanol;2-[5-fluoro-2-(trifluoromethyl)phenyl]-1-propan-2-ylpyrrolidine?

3-(2-tert-butylcyclopentyl)-5-fluoropyridine;2-(1-tert-butylpyrrolidin-2-yl)pyridine;2-(2-chloro-5-fluorophenyl)-1-propan-2-ylpyrrolidine;2-(3-chloro-5-fluorophenyl)-1-propan-2-ylpyrrolidine;5-(2,5-difluorophenyl)-1,2,2-trimethylpyrrolidine;2-[3-fluoro-5-(2-methoxyethoxy)phenyl]-1-methylpyrrolidine;2-(5-fluoro-2-methoxyphenyl)-1-propan-2-ylpyrrolidine;4-[2-[3-fluoro-5-(1-methylpyrrolidin-2-yl)phenoxy]ethyl]morpholine;[5-fluoro-3-(1-methylpyrrolidin-2-yl)-2-pyridinyl]methanol;2-[5-fluoro-2-(trifluoromethyl)phenyl]-1-propan-2-ylpyrrolidine has a molecular weight of 2418.96 g/mol, XLogP of 32.90, 24 rotatable bonds, 1 hydrogen bond donors, and 19 hydrogen bond acceptors.

Where does this data come from?

All data for 3-(2-tert-butylcyclopentyl)-5-fluoropyridine;2-(1-tert-butylpyrrolidin-2-yl)pyridine;2-(2-chloro-5-fluorophenyl)-1-propan-2-ylpyrrolidine;2-(3-chloro-5-fluorophenyl)-1-propan-2-ylpyrrolidine;5-(2,5-difluorophenyl)-1,2,2-trimethylpyrrolidine;2-[3-fluoro-5-(2-methoxyethoxy)phenyl]-1-methylpyrrolidine;2-(5-fluoro-2-methoxyphenyl)-1-propan-2-ylpyrrolidine;4-[2-[3-fluoro-5-(1-methylpyrrolidin-2-yl)phenoxy]ethyl]morpholine;[5-fluoro-3-(1-methylpyrrolidin-2-yl)-2-pyridinyl]methanol;2-[5-fluoro-2-(trifluoromethyl)phenyl]-1-propan-2-ylpyrrolidine is sourced from PubChem (CID 160984211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).