2-(2,5-difluorophenyl)pyrrolidine;6-[(2R)-2-(2,5-difluorophenyl)pyrrolidin-1-yl]imidazo[1,2-a]pyridine-3-carboxylic acid;5-[2-(2,5-difluorophenyl)pyrrolidin-1-yl]-2-nitropyridine;5-[2-(2,5-difluorophenyl)pyrrolidin-1-yl]pyridin-2-amine;ethyl 6-[(2R)-2-(2,5-difluorophenyl)pyrrolidin-1-yl]imidazo[1,2-a]pyridine-3-carboxylate;5-fluoro-2-nitropyridine;hydrochloride — IUPAC name, SMILES, InChIKey & properties

Name: 2-(2,5-difluorophenyl)pyrrolidine;6-[(2R)-2-(2,5-difluorophenyl)pyrrolidin-1-yl]imidazo[1,2-a]pyridine-3-carboxylic acid;5-[2-(2,5-difluorophenyl)pyrrolidin-1-yl]-2-nitropyridine;5-[2-(2,5-difluorophenyl)pyrrolidin-1-yl]pyridin-2-amine;ethyl 6-[(2R)-2-(2,5-difluorophenyl)pyrrolidin-1-yl]imidazo[1,2-a]pyridine-3-carboxylate;5-fluoro-2-nitropyridine;hydrochloride — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

About 2-(2,5-difluorophenyl)pyrrolidine;6-[(2R)-2-(2,5-difluorophenyl)pyrrolidin-1-yl]imidazo[1,2-a]pyridine-3-carboxylic acid;5-[2-(2,5-difluorophenyl)pyrrolidin-1-yl]-2-nitropyridine;5-[2-(2,5-difluorophenyl)pyrrolidin-1-yl]pyridin-2-amine;ethyl 6-[(2R)-2-(2,5-difluorophenyl)pyrrolidin-1-yl]imidazo[1,2-a]pyridine-3-carboxylate;5-fluoro-2-nitropyridine;hydrochloride

2-(2,5-difluorophenyl)pyrrolidine;6-[(2R)-2-(2,5-difluorophenyl)pyrrolidin-1-yl]imidazo[1,2-a]pyridine-3-carboxylic acid;5-[2-(2,5-difluorophenyl)pyrrolidin-1-yl]-2-nitropyridine;5-[2-(2,5-difluorophenyl)pyrrolidin-1-yl]pyridin-2-amine;ethyl 6-[(2R)-2-(2,5-difluorophenyl)pyrrolidin-1-yl]imidazo[1,2-a]pyridine-3-carboxylate;5-fluoro-2-nitropyridine;hydrochloride (PubChem CID 159786918) has the molecular formula C83H77ClF11N15O8 and a molecular weight of 1657.06 g/mol. Its IUPAC name is 2-(2,5-difluorophenyl)pyrrolidine;6-[(2R)-2-(2,5-difluorophenyl)pyrrolidin-1-yl]imidazo[1,2-a]pyridine-3-carboxylic acid;5-[2-(2,5-difluorophenyl)pyrrolidin-1-yl]-2-nitropyridine;5-[2-(2,5-difluorophenyl)pyrrolidin-1-yl]pyridin-2-amine;ethyl 6-[(2R)-2-(2,5-difluorophenyl)pyrrolidin-1-yl]imidazo[1,2-a]pyridine-3-carboxylate;5-fluoro-2-nitropyridine;hydrochloride.

Molecular Properties

Compound Name	2-(2,5-difluorophenyl)pyrrolidine;6-[(2R)-2-(2,5-difluorophenyl)pyrrolidin-1-yl]imidazo[1,2-a]pyridine-3-carboxylic acid;5-[2-(2,5-difluorophenyl)pyrrolidin-1-yl]-2-nitropyridine;5-[2-(2,5-difluorophenyl)pyrrolidin-1-yl]pyridin-2-amine;ethyl 6-[(2R)-2-(2,5-difluorophenyl)pyrrolidin-1-yl]imidazo[1,2-a]pyridine-3-carboxylate;5-fluoro-2-nitropyridine;hydrochloride
PubChem CID	159786918
Molecular Formula	C83H77ClF11N15O8
Molecular Weight	1657.06 g/mol
Exact Mass	1655.56
IUPAC Name	2-(2,5-difluorophenyl)pyrrolidine;6-[(2R)-2-(2,5-difluorophenyl)pyrrolidin-1-yl]imidazo[1,2-a]pyridine-3-carboxylic acid;5-[2-(2,5-difluorophenyl)pyrrolidin-1-yl]-2-nitropyridine;5-[2-(2,5-difluorophenyl)pyrrolidin-1-yl]pyridin-2-amine;ethyl 6-[(2R)-2-(2,5-difluorophenyl)pyrrolidin-1-yl]imidazo[1,2-a]pyridine-3-carboxylate;5-fluoro-2-nitropyridine;hydrochloride
SMILES	CCOC(=O)c1cnc2ccc(N3CCC[C@@H]3c3cc(F)ccc3F)cn12.Cl.Fc1ccc(F)c(C2CCCN2)c1.Nc1ccc(N2CCCC2c2cc(F)ccc2F)cn1.O=C(O)c1cnc2ccc(N3CCC[C@@H]3c3cc(F)ccc3F)cn12.O=[N+]([O-])c1ccc(F)cn1.O=[N+]([O-])c1ccc(N2CCCC2c2cc(F)ccc2F)cn1
InChI	InChI=1S/C20H19F2N3O2.C18H15F2N3O2.C15H13F2N3O2.C15H15F2N3.C10H11F2N.C5H3FN2O2.ClH/c1-2-27-20(26)18-11-23-19-8-6-14(12-25(18)19)24-9-3-4-17(24)15-10-13(21)5-7-16(15)22;19-11-3-5-14(20)13(8-11)15-2-1-7-22(15)12-4-6-17-21-9-16(18(24)25)23(17)10-12;16-10-3-5-13(17)12(8-10)14-2-1-7-19(14)11-4-6-15(18-9-11)20(21)22;16-10-3-5-13(17)12(8-10)14-2-1-7-20(14)11-4-6-15(18)19-9-11;11-7-3-4-9(12)8(6-7)10-2-1-5-13-10;6-4-1-2-5(7-3-4)8(9)10;/h5-8,10-12,17H,2-4,9H2,1H3;3-6,8-10,15H,1-2,7H2,(H,24,25);3-6,8-9,14H,1-2,7H2;3-6,8-9,14H,1-2,7H2,(H2,18,19);3-4,6,10,13H,1-2,5H2;1-3H;1H/t17-;15-;;;;;/m11...../s1
InChIKey	OEQLTGABTTYADM-RMJDKCLSSA-N
XLogP	18.62
TPSA	274.16 Å²
H-Bond Donors	3
H-Bond Acceptors	20
Rotatable Bonds	14
Heavy Atoms	118
Complexity	—

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1657.06
LogP ≤ 5	18.62
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	20

Computed Properties (RDKit)

Structural Alerts	{'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 2-(2,5-difluorophenyl)pyrrolidine;6-[(2R)-2-(2,5-difluorophenyl)pyrrolidin-1-yl]imidazo[1,2-a]pyridine-3-carboxylic acid;5-[2-(2,5-difluorophenyl)pyrrolidin-1-yl]-2-nitropyridine;5-[2-(2,5-difluorophenyl)pyrrolidin-1-yl]pyridin-2-amine;ethyl 6-[(2R)-2-(2,5-difluorophenyl)pyrrolidin-1-yl]imidazo[1,2-a]pyridine-3-carboxylate;5-fluoro-2-nitropyridine;hydrochloride with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-(2,5-difluorophenyl)pyrrolidine;6-[(2R)-2-(2,5-difluorophenyl)pyrrolidin-1-yl]imidazo[1,2-a]pyridine-3-carboxylic acid;5-[2-(2,5-difluorophenyl)pyrrolidin-1-yl]-2-nitropyridine;5-[2-(2,5-difluorophenyl)pyrrolidin-1-yl]pyridin-2-amine;ethyl 6-[(2R)-2-(2,5-difluorophenyl)pyrrolidin-1-yl]imidazo[1,2-a]pyridine-3-carboxylate;5-fluoro-2-nitropyridine;hydrochloride?

The IUPAC name of 2-(2,5-difluorophenyl)pyrrolidine;6-[(2R)-2-(2,5-difluorophenyl)pyrrolidin-1-yl]imidazo[1,2-a]pyridine-3-carboxylic acid;5-[2-(2,5-difluorophenyl)pyrrolidin-1-yl]-2-nitropyridine;5-[2-(2,5-difluorophenyl)pyrrolidin-1-yl]pyridin-2-amine;ethyl 6-[(2R)-2-(2,5-difluorophenyl)pyrrolidin-1-yl]imidazo[1,2-a]pyridine-3-carboxylate;5-fluoro-2-nitropyridine;hydrochloride (CID 159786918) is 2-(2,5-difluorophenyl)pyrrolidine;6-[(2R)-2-(2,5-difluorophenyl)pyrrolidin-1-yl]imidazo[1,2-a]pyridine-3-carboxylic acid;5-[2-(2,5-difluorophenyl)pyrrolidin-1-yl]-2-nitropyridine;5-[2-(2,5-difluorophenyl)pyrrolidin-1-yl]pyridin-2-amine;ethyl 6-[(2R)-2-(2,5-difluorophenyl)pyrrolidin-1-yl]imidazo[1,2-a]pyridine-3-carboxylate;5-fluoro-2-nitropyridine;hydrochloride.

What is the SMILES notation for 2-(2,5-difluorophenyl)pyrrolidine;6-[(2R)-2-(2,5-difluorophenyl)pyrrolidin-1-yl]imidazo[1,2-a]pyridine-3-carboxylic acid;5-[2-(2,5-difluorophenyl)pyrrolidin-1-yl]-2-nitropyridine;5-[2-(2,5-difluorophenyl)pyrrolidin-1-yl]pyridin-2-amine;ethyl 6-[(2R)-2-(2,5-difluorophenyl)pyrrolidin-1-yl]imidazo[1,2-a]pyridine-3-carboxylate;5-fluoro-2-nitropyridine;hydrochloride?

The canonical SMILES for 2-(2,5-difluorophenyl)pyrrolidine;6-[(2R)-2-(2,5-difluorophenyl)pyrrolidin-1-yl]imidazo[1,2-a]pyridine-3-carboxylic acid;5-[2-(2,5-difluorophenyl)pyrrolidin-1-yl]-2-nitropyridine;5-[2-(2,5-difluorophenyl)pyrrolidin-1-yl]pyridin-2-amine;ethyl 6-[(2R)-2-(2,5-difluorophenyl)pyrrolidin-1-yl]imidazo[1,2-a]pyridine-3-carboxylate;5-fluoro-2-nitropyridine;hydrochloride is CCOC(=O)c1cnc2ccc(N3CCC[C@@H]3c3cc(F)ccc3F)cn12.Cl.Fc1ccc(F)c(C2CCCN2)c1.Nc1ccc(N2CCCC2c2cc(F)ccc2F)cn1.O=C(O)c1cnc2ccc(N3CCC[C@@H]3c3cc(F)ccc3F)cn12.O=[N+]([O-])c1ccc(F)cn1.O=[N+]([O-])c1ccc(N2CCCC2c2cc(F)ccc2F)cn1.

What is the InChIKey of 2-(2,5-difluorophenyl)pyrrolidine;6-[(2R)-2-(2,5-difluorophenyl)pyrrolidin-1-yl]imidazo[1,2-a]pyridine-3-carboxylic acid;5-[2-(2,5-difluorophenyl)pyrrolidin-1-yl]-2-nitropyridine;5-[2-(2,5-difluorophenyl)pyrrolidin-1-yl]pyridin-2-amine;ethyl 6-[(2R)-2-(2,5-difluorophenyl)pyrrolidin-1-yl]imidazo[1,2-a]pyridine-3-carboxylate;5-fluoro-2-nitropyridine;hydrochloride?

The InChIKey is OEQLTGABTTYADM-RMJDKCLSSA-N. The full InChI is InChI=1S/C20H19F2N3O2.C18H15F2N3O2.C15H13F2N3O2.C15H15F2N3.C10H11F2N.C5H3FN2O2.ClH/c1-2-27-20(26)18-11-23-19-8-6-14(12-25(18)19)24-9-3-4-17(24)15-10-13(21)5-7-16(15)22;19-11-3-5-14(20)13(8-11)15-2-1-7-22(15)12-4-6-17-21-9-16(18(24)25)23(17)10-12;16-10-3-5-13(17)12(8-10)14-2-1-7-19(14)11-4-6-15(18-9-11)20(21)22;16-10-3-5-13(17)12(8-10)14-2-1-7-20(14)11-4-6-15(18)19-9-11;11-7-3-4-9(12)8(6-7)10-2-1-5-13-10;6-4-1-2-5(7-3-4)8(9)10;/h5-8,10-12,17H,2-4,9H2,1H3;3-6,8-10,15H,1-2,7H2,(H,24,25);3-6,8-9,14H,1-2,7H2;3-6,8-9,14H,1-2,7H2,(H2,18,19);3-4,6,10,13H,1-2,5H2;1-3H;1H/t17-;15-;;;;;/m11...../s1.

What are the key properties of 2-(2,5-difluorophenyl)pyrrolidine;6-[(2R)-2-(2,5-difluorophenyl)pyrrolidin-1-yl]imidazo[1,2-a]pyridine-3-carboxylic acid;5-[2-(2,5-difluorophenyl)pyrrolidin-1-yl]-2-nitropyridine;5-[2-(2,5-difluorophenyl)pyrrolidin-1-yl]pyridin-2-amine;ethyl 6-[(2R)-2-(2,5-difluorophenyl)pyrrolidin-1-yl]imidazo[1,2-a]pyridine-3-carboxylate;5-fluoro-2-nitropyridine;hydrochloride?

Where does this data come from?

All data for 2-(2,5-difluorophenyl)pyrrolidine;6-[(2R)-2-(2,5-difluorophenyl)pyrrolidin-1-yl]imidazo[1,2-a]pyridine-3-carboxylic acid;5-[2-(2,5-difluorophenyl)pyrrolidin-1-yl]-2-nitropyridine;5-[2-(2,5-difluorophenyl)pyrrolidin-1-yl]pyridin-2-amine;ethyl 6-[(2R)-2-(2,5-difluorophenyl)pyrrolidin-1-yl]imidazo[1,2-a]pyridine-3-carboxylate;5-fluoro-2-nitropyridine;hydrochloride is sourced from PubChem (CID 159786918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).