6-(1-tert-butylpyrrolidin-3-yl)oxy-3-fluoro-2-methoxypyridine;2-(1-tert-butylpyrrolidin-3-yl)oxy-5-fluoropyridine;3-(1-tert-butylpyrrolidin-3-yl)oxy-5-fluoropyridine;2-(1-tert-butylpyrrolidin-3-yl)oxy-6-methoxypyridine;3-(1-tert-butylpyrrolidin-3-yl)oxy-5-methoxypyridine;2-(1-tert-butylpyrrolidin-3-yl)oxy-6-methylpyridine;3-chloro-2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-chloro-2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;3-fluoro-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-fluoro-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine

C132H197Cl2F5N20O15 — CID 162234413

IUPAC6-(1-tert-butylpyrrolidin-3-yl)oxy-3-fluoro-2-methoxypyridine;2-(1-tert-butylpyrrolidin-3-yl)oxy-5-fluoropyridine;3-(1-tert-butylpyrrolidin-3-yl)oxy-5-fluoropyridine;2-(1-tert-butylpyrrolidin-3-yl)oxy-6-methoxypyridine;3-(1-tert-butylpyrrolidin-3-yl)oxy-5-methoxypyridine;2-(1-tert-butylpyrrolidin-3-yl)oxy-6-methylpyridine;3-chloro-2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-chloro-2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;3-fluoro-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-fluoro-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine
SMILESCC(C)(C)N1CCC(Oc2ccc(F)cn2)C1.CC(C)(C)N1CCC(Oc2cncc(F)c2)C1.CC(C)N1CC(Oc2cncc(F)c2)C1.CC(C)N1CCC(Oc2cncc(F)c2)CC1.COc1cccc(OC2CCN(C(C)(C)C)C2)n1.COc1cncc(OC2CCN(C(C)(C)C)C2)c1.COc1nc(OC2CCN(C(C)(C)C)C2)ccc1F.COc1ncc(OC2CCN(C(C)C)CC2)cc1Cl.COc1ncc(OC2CN(C(C)C)C2)cc1Cl.Cc1cccc(OC2CCN(C(C)(C)C)C2)n1
InChIInChI=1S/C14H21ClN2O2.C14H21FN2O2.2C14H22N2O2.C14H22N2O.3C13H19FN2O.C12H17ClN2O2.C11H15FN2O/c1-10(2)17-6-4-11(5-7-17)19-12-8-13(15)14(18-3)16-9-12;1-14(2,3)17-8-7-10(9-17)19-12-6-5-11(15)13(16-12)18-4;1-14(2,3)16-6-5-11(10-16)18-13-7-12(17-4)8-15-9-13;1-14(2,3)16-9-8-11(10-16)18-13-7-5-6-12(15-13)17-4;1-11-6-5-7-13(15-11)17-12-8-9-16(10-12)14(2,3)4;1-13(2,3)16-5-4-11(9-16)17-12-6-10(14)7-15-8-12;1-13(2,3)16-7-6-11(9-16)17-12-5-4-10(14)8-15-12;1-10(2)16-5-3-12(4-6-16)17-13-7-11(14)8-15-9-13;1-8(2)15-6-10(7-15)17-9-4-11(13)12(16-3)14-5-9;1-8(2)14-6-11(7-14)15-10-3-9(12)4-13-5-10/h8-11H,4-7H2,1-3H3;5-6,10H,7-9H2,1-4H3;7-9,11H,5-6,10H2,1-4H3;5-7,11H,8-10H2,1-4H3;5-7,12H,8-10H2,1-4H3;6-8,11H,4-5,9H2,1-3H3;4-5,8,11H,6-7,9H2,1-3H3;7-10,12H,3-6H2,1-2H3;4-5,8,10H,6-7H2,1-3H3;3-5,8,11H,6-7H2,1-2H3
InChIKeyZVWHHQXPDGJKIK-UHFFFAOYSA-N
MW2470.05 g/mol
LogP24.13
Rot. Bonds29

About 6-(1-tert-butylpyrrolidin-3-yl)oxy-3-fluoro-2-methoxypyridine;2-(1-tert-butylpyrrolidin-3-yl)oxy-5-fluoropyridine;3-(1-tert-butylpyrrolidin-3-yl)oxy-5-fluoropyridine;2-(1-tert-butylpyrrolidin-3-yl)oxy-6-methoxypyridine;3-(1-tert-butylpyrrolidin-3-yl)oxy-5-methoxypyridine;2-(1-tert-butylpyrrolidin-3-yl)oxy-6-methylpyridine;3-chloro-2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-chloro-2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;3-fluoro-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-fluoro-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine

6-(1-tert-butylpyrrolidin-3-yl)oxy-3-fluoro-2-methoxypyridine;2-(1-tert-butylpyrrolidin-3-yl)oxy-5-fluoropyridine;3-(1-tert-butylpyrrolidin-3-yl)oxy-5-fluoropyridine;2-(1-tert-butylpyrrolidin-3-yl)oxy-6-methoxypyridine;3-(1-tert-butylpyrrolidin-3-yl)oxy-5-methoxypyridine;2-(1-tert-butylpyrrolidin-3-yl)oxy-6-methylpyridine;3-chloro-2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-chloro-2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;3-fluoro-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-fluoro-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine (PubChem CID 162234413) has the molecular formula C132H197Cl2F5N20O15 and a molecular weight of 2470.05 g/mol. Its IUPAC name is 6-(1-tert-butylpyrrolidin-3-yl)oxy-3-fluoro-2-methoxypyridine;2-(1-tert-butylpyrrolidin-3-yl)oxy-5-fluoropyridine;3-(1-tert-butylpyrrolidin-3-yl)oxy-5-fluoropyridine;2-(1-tert-butylpyrrolidin-3-yl)oxy-6-methoxypyridine;3-(1-tert-butylpyrrolidin-3-yl)oxy-5-methoxypyridine;2-(1-tert-butylpyrrolidin-3-yl)oxy-6-methylpyridine;3-chloro-2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-chloro-2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;3-fluoro-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-fluoro-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine.

Molecular Properties

Compound Name6-(1-tert-butylpyrrolidin-3-yl)oxy-3-fluoro-2-methoxypyridine;2-(1-tert-butylpyrrolidin-3-yl)oxy-5-fluoropyridine;3-(1-tert-butylpyrrolidin-3-yl)oxy-5-fluoropyridine;2-(1-tert-butylpyrrolidin-3-yl)oxy-6-methoxypyridine;3-(1-tert-butylpyrrolidin-3-yl)oxy-5-methoxypyridine;2-(1-tert-butylpyrrolidin-3-yl)oxy-6-methylpyridine;3-chloro-2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-chloro-2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;3-fluoro-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-fluoro-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine
PubChem CID162234413
Molecular FormulaC132H197Cl2F5N20O15
Molecular Weight2470.05 g/mol
Exact Mass2467.46
IUPAC Name6-(1-tert-butylpyrrolidin-3-yl)oxy-3-fluoro-2-methoxypyridine;2-(1-tert-butylpyrrolidin-3-yl)oxy-5-fluoropyridine;3-(1-tert-butylpyrrolidin-3-yl)oxy-5-fluoropyridine;2-(1-tert-butylpyrrolidin-3-yl)oxy-6-methoxypyridine;3-(1-tert-butylpyrrolidin-3-yl)oxy-5-methoxypyridine;2-(1-tert-butylpyrrolidin-3-yl)oxy-6-methylpyridine;3-chloro-2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-chloro-2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;3-fluoro-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-fluoro-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine
SMILESCC(C)(C)N1CCC(Oc2ccc(F)cn2)C1.CC(C)(C)N1CCC(Oc2cncc(F)c2)C1.CC(C)N1CC(Oc2cncc(F)c2)C1.CC(C)N1CCC(Oc2cncc(F)c2)CC1.COc1cccc(OC2CCN(C(C)(C)C)C2)n1.COc1cncc(OC2CCN(C(C)(C)C)C2)c1.COc1nc(OC2CCN(C(C)(C)C)C2)ccc1F.COc1ncc(OC2CCN(C(C)C)CC2)cc1Cl.COc1ncc(OC2CN(C(C)C)C2)cc1Cl.Cc1cccc(OC2CCN(C(C)(C)C)C2)n1
InChIInChI=1S/C14H21ClN2O2.C14H21FN2O2.2C14H22N2O2.C14H22N2O.3C13H19FN2O.C12H17ClN2O2.C11H15FN2O/c1-10(2)17-6-4-11(5-7-17)19-12-8-13(15)14(18-3)16-9-12;1-14(2,3)17-8-7-10(9-17)19-12-6-5-11(15)13(16-12)18-4;1-14(2,3)16-6-5-11(10-16)18-13-7-12(17-4)8-15-9-13;1-14(2,3)16-9-8-11(10-16)18-13-7-5-6-12(15-13)17-4;1-11-6-5-7-13(15-11)17-12-8-9-16(10-12)14(2,3)4;1-13(2,3)16-5-4-11(9-16)17-12-6-10(14)7-15-8-12;1-13(2,3)16-7-6-11(9-16)17-12-5-4-10(14)8-15-12;1-10(2)16-5-3-12(4-6-16)17-13-7-11(14)8-15-9-13;1-8(2)15-6-10(7-15)17-9-4-11(13)12(16-3)14-5-9;1-8(2)14-6-11(7-14)15-10-3-9(12)4-13-5-10/h8-11H,4-7H2,1-3H3;5-6,10H,7-9H2,1-4H3;7-9,11H,5-6,10H2,1-4H3;5-7,11H,8-10H2,1-4H3;5-7,12H,8-10H2,1-4H3;6-8,11H,4-5,9H2,1-3H3;4-5,8,11H,6-7,9H2,1-3H3;7-10,12H,3-6H2,1-2H3;4-5,8,10H,6-7H2,1-3H3;3-5,8,11H,6-7H2,1-2H3
InChIKeyZVWHHQXPDGJKIK-UHFFFAOYSA-N
XLogP24.13
TPSA299.75 Ų
H-Bond Donors
H-Bond Acceptors35
Rotatable Bonds29
Heavy Atoms174
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002470.05
LogP ≤ 524.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1035

Analyze 6-(1-tert-butylpyrrolidin-3-yl)oxy-3-fluoro-2-methoxypyridine;2-(1-tert-butylpyrrolidin-3-yl)oxy-5-fluoropyridine;3-(1-tert-butylpyrrolidin-3-yl)oxy-5-fluoropyridine;2-(1-tert-butylpyrrolidin-3-yl)oxy-6-methoxypyridine;3-(1-tert-butylpyrrolidin-3-yl)oxy-5-methoxypyridine;2-(1-tert-butylpyrrolidin-3-yl)oxy-6-methylpyridine;3-chloro-2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-chloro-2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;3-fluoro-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-fluoro-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 6-(1-tert-butylpyrrolidin-3-yl)oxy-3-fluoro-2-methoxypyridine;2-(1-tert-butylpyrrolidin-3-yl)oxy-5-fluoropyridine;3-(1-tert-butylpyrrolidin-3-yl)oxy-5-fluoropyridine;2-(1-tert-butylpyrrolidin-3-yl)oxy-6-methoxypyridine;3-(1-tert-butylpyrrolidin-3-yl)oxy-5-methoxypyridine;2-(1-tert-butylpyrrolidin-3-yl)oxy-6-methylpyridine;3-chloro-2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-chloro-2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;3-fluoro-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-fluoro-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine?
The IUPAC name of 6-(1-tert-butylpyrrolidin-3-yl)oxy-3-fluoro-2-methoxypyridine;2-(1-tert-butylpyrrolidin-3-yl)oxy-5-fluoropyridine;3-(1-tert-butylpyrrolidin-3-yl)oxy-5-fluoropyridine;2-(1-tert-butylpyrrolidin-3-yl)oxy-6-methoxypyridine;3-(1-tert-butylpyrrolidin-3-yl)oxy-5-methoxypyridine;2-(1-tert-butylpyrrolidin-3-yl)oxy-6-methylpyridine;3-chloro-2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-chloro-2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;3-fluoro-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-fluoro-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine (CID 162234413) is 6-(1-tert-butylpyrrolidin-3-yl)oxy-3-fluoro-2-methoxypyridine;2-(1-tert-butylpyrrolidin-3-yl)oxy-5-fluoropyridine;3-(1-tert-butylpyrrolidin-3-yl)oxy-5-fluoropyridine;2-(1-tert-butylpyrrolidin-3-yl)oxy-6-methoxypyridine;3-(1-tert-butylpyrrolidin-3-yl)oxy-5-methoxypyridine;2-(1-tert-butylpyrrolidin-3-yl)oxy-6-methylpyridine;3-chloro-2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-chloro-2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;3-fluoro-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-fluoro-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine.
What is the SMILES notation for 6-(1-tert-butylpyrrolidin-3-yl)oxy-3-fluoro-2-methoxypyridine;2-(1-tert-butylpyrrolidin-3-yl)oxy-5-fluoropyridine;3-(1-tert-butylpyrrolidin-3-yl)oxy-5-fluoropyridine;2-(1-tert-butylpyrrolidin-3-yl)oxy-6-methoxypyridine;3-(1-tert-butylpyrrolidin-3-yl)oxy-5-methoxypyridine;2-(1-tert-butylpyrrolidin-3-yl)oxy-6-methylpyridine;3-chloro-2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-chloro-2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;3-fluoro-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-fluoro-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine?
The canonical SMILES for 6-(1-tert-butylpyrrolidin-3-yl)oxy-3-fluoro-2-methoxypyridine;2-(1-tert-butylpyrrolidin-3-yl)oxy-5-fluoropyridine;3-(1-tert-butylpyrrolidin-3-yl)oxy-5-fluoropyridine;2-(1-tert-butylpyrrolidin-3-yl)oxy-6-methoxypyridine;3-(1-tert-butylpyrrolidin-3-yl)oxy-5-methoxypyridine;2-(1-tert-butylpyrrolidin-3-yl)oxy-6-methylpyridine;3-chloro-2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-chloro-2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;3-fluoro-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-fluoro-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine is CC(C)(C)N1CCC(Oc2ccc(F)cn2)C1.CC(C)(C)N1CCC(Oc2cncc(F)c2)C1.CC(C)N1CC(Oc2cncc(F)c2)C1.CC(C)N1CCC(Oc2cncc(F)c2)CC1.COc1cccc(OC2CCN(C(C)(C)C)C2)n1.COc1cncc(OC2CCN(C(C)(C)C)C2)c1.COc1nc(OC2CCN(C(C)(C)C)C2)ccc1F.COc1ncc(OC2CCN(C(C)C)CC2)cc1Cl.COc1ncc(OC2CN(C(C)C)C2)cc1Cl.Cc1cccc(OC2CCN(C(C)(C)C)C2)n1.
What is the InChIKey of 6-(1-tert-butylpyrrolidin-3-yl)oxy-3-fluoro-2-methoxypyridine;2-(1-tert-butylpyrrolidin-3-yl)oxy-5-fluoropyridine;3-(1-tert-butylpyrrolidin-3-yl)oxy-5-fluoropyridine;2-(1-tert-butylpyrrolidin-3-yl)oxy-6-methoxypyridine;3-(1-tert-butylpyrrolidin-3-yl)oxy-5-methoxypyridine;2-(1-tert-butylpyrrolidin-3-yl)oxy-6-methylpyridine;3-chloro-2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-chloro-2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;3-fluoro-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-fluoro-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine?
The InChIKey is ZVWHHQXPDGJKIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21ClN2O2.C14H21FN2O2.2C14H22N2O2.C14H22N2O.3C13H19FN2O.C12H17ClN2O2.C11H15FN2O/c1-10(2)17-6-4-11(5-7-17)19-12-8-13(15)14(18-3)16-9-12;1-14(2,3)17-8-7-10(9-17)19-12-6-5-11(15)13(16-12)18-4;1-14(2,3)16-6-5-11(10-16)18-13-7-12(17-4)8-15-9-13;1-14(2,3)16-9-8-11(10-16)18-13-7-5-6-12(15-13)17-4;1-11-6-5-7-13(15-11)17-12-8-9-16(10-12)14(2,3)4;1-13(2,3)16-5-4-11(9-16)17-12-6-10(14)7-15-8-12;1-13(2,3)16-7-6-11(9-16)17-12-5-4-10(14)8-15-12;1-10(2)16-5-3-12(4-6-16)17-13-7-11(14)8-15-9-13;1-8(2)15-6-10(7-15)17-9-4-11(13)12(16-3)14-5-9;1-8(2)14-6-11(7-14)15-10-3-9(12)4-13-5-10/h8-11H,4-7H2,1-3H3;5-6,10H,7-9H2,1-4H3;7-9,11H,5-6,10H2,1-4H3;5-7,11H,8-10H2,1-4H3;5-7,12H,8-10H2,1-4H3;6-8,11H,4-5,9H2,1-3H3;4-5,8,11H,6-7,9H2,1-3H3;7-10,12H,3-6H2,1-2H3;4-5,8,10H,6-7H2,1-3H3;3-5,8,11H,6-7H2,1-2H3.
What are the key properties of 6-(1-tert-butylpyrrolidin-3-yl)oxy-3-fluoro-2-methoxypyridine;2-(1-tert-butylpyrrolidin-3-yl)oxy-5-fluoropyridine;3-(1-tert-butylpyrrolidin-3-yl)oxy-5-fluoropyridine;2-(1-tert-butylpyrrolidin-3-yl)oxy-6-methoxypyridine;3-(1-tert-butylpyrrolidin-3-yl)oxy-5-methoxypyridine;2-(1-tert-butylpyrrolidin-3-yl)oxy-6-methylpyridine;3-chloro-2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-chloro-2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;3-fluoro-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-fluoro-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine?
6-(1-tert-butylpyrrolidin-3-yl)oxy-3-fluoro-2-methoxypyridine;2-(1-tert-butylpyrrolidin-3-yl)oxy-5-fluoropyridine;3-(1-tert-butylpyrrolidin-3-yl)oxy-5-fluoropyridine;2-(1-tert-butylpyrrolidin-3-yl)oxy-6-methoxypyridine;3-(1-tert-butylpyrrolidin-3-yl)oxy-5-methoxypyridine;2-(1-tert-butylpyrrolidin-3-yl)oxy-6-methylpyridine;3-chloro-2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-chloro-2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;3-fluoro-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-fluoro-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine has a molecular weight of 2470.05 g/mol, XLogP of 24.13, 29 rotatable bonds, 0 hydrogen bond donors, and 35 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1-tert-butylpyrrolidin-3-yl)oxy-3-fluoro-2-methoxypyridine;2-(1-tert-butylpyrrolidin-3-yl)oxy-5-fluoropyridine;3-(1-tert-butylpyrrolidin-3-yl)oxy-5-fluoropyridine;2-(1-tert-butylpyrrolidin-3-yl)oxy-6-methoxypyridine;3-(1-tert-butylpyrrolidin-3-yl)oxy-5-methoxypyridine;2-(1-tert-butylpyrrolidin-3-yl)oxy-6-methylpyridine;3-chloro-2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-chloro-2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;3-fluoro-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-fluoro-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine is sourced from PubChem (CID 162234413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).