4-(furan-2-yl)-2-methyl-5-[(2S)-1-methylpyrrolidin-2-yl]pyridine;4-(1H-imidazol-5-yl)-3-[(2S)-1-methylpyrrolidin-2-yl]pyridine;2-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,3-oxazole;3-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,2-oxazole;5-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,2-oxazole;5-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,3-oxazole;2-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,3-thiazole

C93H109N21O5S — CID 160889389

IUPAC4-(furan-2-yl)-2-methyl-5-[(2S)-1-methylpyrrolidin-2-yl]pyridine;4-(1H-imidazol-5-yl)-3-[(2S)-1-methylpyrrolidin-2-yl]pyridine;2-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,3-oxazole;3-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,2-oxazole;5-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,2-oxazole;5-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,3-oxazole;2-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,3-thiazole
SMILESCN1CCC[C@H]1c1cnccc1-c1ccno1.CN1CCC[C@H]1c1cnccc1-c1ccon1.CN1CCC[C@H]1c1cnccc1-c1cnc[nH]1.CN1CCC[C@H]1c1cnccc1-c1cnco1.CN1CCC[C@H]1c1cnccc1-c1ncco1.CN1CCC[C@H]1c1cnccc1-c1nccs1.Cc1cc(-c2ccco2)c([C@@H]2CCCN2C)cn1
InChIInChI=1S/C15H18N2O.C13H16N4.4C13H15N3O.C13H15N3S/c1-11-9-12(15-6-4-8-18-15)13(10-16-11)14-5-3-7-17(14)2;1-17-6-2-3-13(17)11-7-14-5-4-10(11)12-8-15-9-16-12;1-16-8-2-3-12(16)11-9-14-6-4-10(11)13-5-7-15-17-13;1-16-7-2-3-13(16)11-9-14-6-4-10(11)12-5-8-17-15-12;1-16-7-2-3-12(16)11-9-14-5-4-10(11)13-15-6-8-17-13;1-16-6-2-3-12(16)11-7-14-5-4-10(11)13-8-15-9-17-13;1-16-7-2-3-12(16)11-9-14-5-4-10(11)13-15-6-8-17-13/h4,6,8-10,14H,3,5,7H2,1-2H3;4-5,7-9,13H,2-3,6H2,1H3,(H,15,16);4-7,9,12H,2-3,8H2,1H3;4-6,8-9,13H,2-3,7H2,1H3;4-6,8-9,12H,2-3,7H2,1H3;4-5,7-9,12H,2-3,6H2,1H3;4-6,8-9,12H,2-3,7H2,1H3/t14-;13-;12-;13-;3*12-/m0000000/s1
InChIKeySOBIJZSTLZPYES-JNEBTIIDSA-N
MW1633.10 g/mol
LogP18.64
Rot. Bonds14

About 4-(furan-2-yl)-2-methyl-5-[(2S)-1-methylpyrrolidin-2-yl]pyridine;4-(1H-imidazol-5-yl)-3-[(2S)-1-methylpyrrolidin-2-yl]pyridine;2-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,3-oxazole;3-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,2-oxazole;5-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,2-oxazole;5-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,3-oxazole;2-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,3-thiazole

4-(furan-2-yl)-2-methyl-5-[(2S)-1-methylpyrrolidin-2-yl]pyridine;4-(1H-imidazol-5-yl)-3-[(2S)-1-methylpyrrolidin-2-yl]pyridine;2-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,3-oxazole;3-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,2-oxazole;5-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,2-oxazole;5-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,3-oxazole;2-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,3-thiazole (PubChem CID 160889389) has the molecular formula C93H109N21O5S and a molecular weight of 1633.10 g/mol. Its IUPAC name is 4-(furan-2-yl)-2-methyl-5-[(2S)-1-methylpyrrolidin-2-yl]pyridine;4-(1H-imidazol-5-yl)-3-[(2S)-1-methylpyrrolidin-2-yl]pyridine;2-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,3-oxazole;3-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,2-oxazole;5-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,2-oxazole;5-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,3-oxazole;2-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,3-thiazole.

Molecular Properties

Compound Name4-(furan-2-yl)-2-methyl-5-[(2S)-1-methylpyrrolidin-2-yl]pyridine;4-(1H-imidazol-5-yl)-3-[(2S)-1-methylpyrrolidin-2-yl]pyridine;2-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,3-oxazole;3-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,2-oxazole;5-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,2-oxazole;5-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,3-oxazole;2-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,3-thiazole
PubChem CID160889389
Molecular FormulaC93H109N21O5S
Molecular Weight1633.10 g/mol
Exact Mass1631.86
IUPAC Name4-(furan-2-yl)-2-methyl-5-[(2S)-1-methylpyrrolidin-2-yl]pyridine;4-(1H-imidazol-5-yl)-3-[(2S)-1-methylpyrrolidin-2-yl]pyridine;2-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,3-oxazole;3-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,2-oxazole;5-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,2-oxazole;5-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,3-oxazole;2-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,3-thiazole
SMILESCN1CCC[C@H]1c1cnccc1-c1ccno1.CN1CCC[C@H]1c1cnccc1-c1ccon1.CN1CCC[C@H]1c1cnccc1-c1cnc[nH]1.CN1CCC[C@H]1c1cnccc1-c1cnco1.CN1CCC[C@H]1c1cnccc1-c1ncco1.CN1CCC[C@H]1c1cnccc1-c1nccs1.Cc1cc(-c2ccco2)c([C@@H]2CCCN2C)cn1
InChIInChI=1S/C15H18N2O.C13H16N4.4C13H15N3O.C13H15N3S/c1-11-9-12(15-6-4-8-18-15)13(10-16-11)14-5-3-7-17(14)2;1-17-6-2-3-13(17)11-7-14-5-4-10(11)12-8-15-9-16-12;1-16-8-2-3-12(16)11-9-14-6-4-10(11)13-5-7-15-17-13;1-16-7-2-3-13(16)11-9-14-6-4-10(11)12-5-8-17-15-12;1-16-7-2-3-12(16)11-9-14-5-4-10(11)13-15-6-8-17-13;1-16-6-2-3-12(16)11-7-14-5-4-10(11)13-8-15-9-17-13;1-16-7-2-3-12(16)11-9-14-5-4-10(11)13-15-6-8-17-13/h4,6,8-10,14H,3,5,7H2,1-2H3;4-5,7-9,13H,2-3,6H2,1H3,(H,15,16);4-7,9,12H,2-3,8H2,1H3;4-6,8-9,13H,2-3,7H2,1H3;4-6,8-9,12H,2-3,7H2,1H3;4-5,7-9,12H,2-3,6H2,1H3;4-6,8-9,12H,2-3,7H2,1H3/t14-;13-;12-;13-;3*12-/m0000000/s1
InChIKeySOBIJZSTLZPYES-JNEBTIIDSA-N
XLogP18.64
TPSA271.74 Ų
H-Bond Donors1
H-Bond Acceptors26
Rotatable Bonds14
Heavy Atoms120
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001633.10
LogP ≤ 518.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1026

Analyze 4-(furan-2-yl)-2-methyl-5-[(2S)-1-methylpyrrolidin-2-yl]pyridine;4-(1H-imidazol-5-yl)-3-[(2S)-1-methylpyrrolidin-2-yl]pyridine;2-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,3-oxazole;3-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,2-oxazole;5-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,2-oxazole;5-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,3-oxazole;2-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,3-thiazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-(furan-2-yl)-2-methyl-5-[(2S)-1-methylpyrrolidin-2-yl]pyridine;4-(1H-imidazol-5-yl)-3-[(2S)-1-methylpyrrolidin-2-yl]pyridine;2-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,3-oxazole;3-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,2-oxazole;5-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,2-oxazole;5-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,3-oxazole;2-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,3-thiazole?
The IUPAC name of 4-(furan-2-yl)-2-methyl-5-[(2S)-1-methylpyrrolidin-2-yl]pyridine;4-(1H-imidazol-5-yl)-3-[(2S)-1-methylpyrrolidin-2-yl]pyridine;2-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,3-oxazole;3-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,2-oxazole;5-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,2-oxazole;5-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,3-oxazole;2-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,3-thiazole (CID 160889389) is 4-(furan-2-yl)-2-methyl-5-[(2S)-1-methylpyrrolidin-2-yl]pyridine;4-(1H-imidazol-5-yl)-3-[(2S)-1-methylpyrrolidin-2-yl]pyridine;2-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,3-oxazole;3-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,2-oxazole;5-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,2-oxazole;5-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,3-oxazole;2-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,3-thiazole.
What is the SMILES notation for 4-(furan-2-yl)-2-methyl-5-[(2S)-1-methylpyrrolidin-2-yl]pyridine;4-(1H-imidazol-5-yl)-3-[(2S)-1-methylpyrrolidin-2-yl]pyridine;2-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,3-oxazole;3-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,2-oxazole;5-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,2-oxazole;5-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,3-oxazole;2-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,3-thiazole?
The canonical SMILES for 4-(furan-2-yl)-2-methyl-5-[(2S)-1-methylpyrrolidin-2-yl]pyridine;4-(1H-imidazol-5-yl)-3-[(2S)-1-methylpyrrolidin-2-yl]pyridine;2-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,3-oxazole;3-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,2-oxazole;5-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,2-oxazole;5-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,3-oxazole;2-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,3-thiazole is CN1CCC[C@H]1c1cnccc1-c1ccno1.CN1CCC[C@H]1c1cnccc1-c1ccon1.CN1CCC[C@H]1c1cnccc1-c1cnc[nH]1.CN1CCC[C@H]1c1cnccc1-c1cnco1.CN1CCC[C@H]1c1cnccc1-c1ncco1.CN1CCC[C@H]1c1cnccc1-c1nccs1.Cc1cc(-c2ccco2)c([C@@H]2CCCN2C)cn1.
What is the InChIKey of 4-(furan-2-yl)-2-methyl-5-[(2S)-1-methylpyrrolidin-2-yl]pyridine;4-(1H-imidazol-5-yl)-3-[(2S)-1-methylpyrrolidin-2-yl]pyridine;2-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,3-oxazole;3-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,2-oxazole;5-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,2-oxazole;5-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,3-oxazole;2-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,3-thiazole?
The InChIKey is SOBIJZSTLZPYES-JNEBTIIDSA-N. The full InChI is InChI=1S/C15H18N2O.C13H16N4.4C13H15N3O.C13H15N3S/c1-11-9-12(15-6-4-8-18-15)13(10-16-11)14-5-3-7-17(14)2;1-17-6-2-3-13(17)11-7-14-5-4-10(11)12-8-15-9-16-12;1-16-8-2-3-12(16)11-9-14-6-4-10(11)13-5-7-15-17-13;1-16-7-2-3-13(16)11-9-14-6-4-10(11)12-5-8-17-15-12;1-16-7-2-3-12(16)11-9-14-5-4-10(11)13-15-6-8-17-13;1-16-6-2-3-12(16)11-7-14-5-4-10(11)13-8-15-9-17-13;1-16-7-2-3-12(16)11-9-14-5-4-10(11)13-15-6-8-17-13/h4,6,8-10,14H,3,5,7H2,1-2H3;4-5,7-9,13H,2-3,6H2,1H3,(H,15,16);4-7,9,12H,2-3,8H2,1H3;4-6,8-9,13H,2-3,7H2,1H3;4-6,8-9,12H,2-3,7H2,1H3;4-5,7-9,12H,2-3,6H2,1H3;4-6,8-9,12H,2-3,7H2,1H3/t14-;13-;12-;13-;3*12-/m0000000/s1.
What are the key properties of 4-(furan-2-yl)-2-methyl-5-[(2S)-1-methylpyrrolidin-2-yl]pyridine;4-(1H-imidazol-5-yl)-3-[(2S)-1-methylpyrrolidin-2-yl]pyridine;2-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,3-oxazole;3-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,2-oxazole;5-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,2-oxazole;5-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,3-oxazole;2-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,3-thiazole?
4-(furan-2-yl)-2-methyl-5-[(2S)-1-methylpyrrolidin-2-yl]pyridine;4-(1H-imidazol-5-yl)-3-[(2S)-1-methylpyrrolidin-2-yl]pyridine;2-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,3-oxazole;3-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,2-oxazole;5-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,2-oxazole;5-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,3-oxazole;2-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,3-thiazole has a molecular weight of 1633.10 g/mol, XLogP of 18.64, 14 rotatable bonds, 1 hydrogen bond donors, and 26 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(furan-2-yl)-2-methyl-5-[(2S)-1-methylpyrrolidin-2-yl]pyridine;4-(1H-imidazol-5-yl)-3-[(2S)-1-methylpyrrolidin-2-yl]pyridine;2-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,3-oxazole;3-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,2-oxazole;5-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,2-oxazole;5-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,3-oxazole;2-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,3-thiazole is sourced from PubChem (CID 160889389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).