5-(1-tert-butylpyrrolidin-3-yl)oxy-2-methoxypyridine;2-(1-tert-butylpyrrolidin-3-yl)oxypyrazine;3-fluoro-2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-fluoro-2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyrazine;3-methoxy-6-(1-propan-2-ylazetidin-3-yl)oxypyridazine;2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyrimidine;2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyrazine;2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyrimidine

C111H172F2N24O17 — CID 162109264

IUPAC5-(1-tert-butylpyrrolidin-3-yl)oxy-2-methoxypyridine;2-(1-tert-butylpyrrolidin-3-yl)oxypyrazine;3-fluoro-2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-fluoro-2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyrazine;3-methoxy-6-(1-propan-2-ylazetidin-3-yl)oxypyridazine;2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyrimidine;2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyrazine;2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyrimidine
SMILESCC(C)(C)N1CCC(Oc2cnccn2)C1.COc1ccc(OC2CCN(C(C)(C)C)C2)cn1.COc1ccc(OC2CN(C(C)C)C2)nn1.COc1cnc(OC2CCN(C(C)C)CC2)cn1.COc1cnc(OC2CN(C(C)C)C2)cn1.COc1ncc(OC2CCN(C(C)C)CC2)cc1F.COc1ncc(OC2CCN(C(C)C)CC2)cn1.COc1ncc(OC2CN(C(C)C)C2)cc1F.COc1ncc(OC2CN(C(C)C)C2)cn1
InChIInChI=1S/C14H21FN2O2.C14H22N2O2.2C13H21N3O2.C12H17FN2O2.C12H19N3O.3C11H17N3O2/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)16-8-7-12(10-16)18-11-5-6-13(17-4)15-9-11;1-10(2)16-6-4-11(5-7-16)18-13-9-14-12(17-3)8-15-13;1-10(2)16-6-4-11(5-7-16)18-12-8-14-13(17-3)15-9-12;1-8(2)15-6-10(7-15)17-9-4-11(13)12(16-3)14-5-9;1-12(2,3)15-7-4-10(9-15)16-11-8-13-5-6-14-11;1-8(2)14-6-9(7-14)16-11-5-12-10(15-3)4-13-11;1-8(2)14-6-10(7-14)16-9-4-12-11(15-3)13-5-9;1-8(2)14-6-9(7-14)16-11-5-4-10(15-3)12-13-11/h8-11H,4-7H2,1-3H3;5-6,9,12H,7-8,10H2,1-4H3;2*8-11H,4-7H2,1-3H3;4-5,8,10H,6-7H2,1-3H3;5-6,8,10H,4,7,9H2,1-3H3;4-5,8-9H,6-7H2,1-3H3;4-5,8,10H,6-7H2,1-3H3;4-5,8-9H,6-7H2,1-3H3
InChIKeyZFXXTYMBKMIZNQ-UHFFFAOYSA-N
MW2152.74 g/mol
LogP14.60
Rot. Bonds33

About 5-(1-tert-butylpyrrolidin-3-yl)oxy-2-methoxypyridine;2-(1-tert-butylpyrrolidin-3-yl)oxypyrazine;3-fluoro-2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-fluoro-2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyrazine;3-methoxy-6-(1-propan-2-ylazetidin-3-yl)oxypyridazine;2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyrimidine;2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyrazine;2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyrimidine

5-(1-tert-butylpyrrolidin-3-yl)oxy-2-methoxypyridine;2-(1-tert-butylpyrrolidin-3-yl)oxypyrazine;3-fluoro-2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-fluoro-2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyrazine;3-methoxy-6-(1-propan-2-ylazetidin-3-yl)oxypyridazine;2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyrimidine;2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyrazine;2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyrimidine (PubChem CID 162109264) has the molecular formula C111H172F2N24O17 and a molecular weight of 2152.74 g/mol. Its IUPAC name is 5-(1-tert-butylpyrrolidin-3-yl)oxy-2-methoxypyridine;2-(1-tert-butylpyrrolidin-3-yl)oxypyrazine;3-fluoro-2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-fluoro-2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyrazine;3-methoxy-6-(1-propan-2-ylazetidin-3-yl)oxypyridazine;2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyrimidine;2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyrazine;2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyrimidine.

Molecular Properties

Compound Name5-(1-tert-butylpyrrolidin-3-yl)oxy-2-methoxypyridine;2-(1-tert-butylpyrrolidin-3-yl)oxypyrazine;3-fluoro-2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-fluoro-2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyrazine;3-methoxy-6-(1-propan-2-ylazetidin-3-yl)oxypyridazine;2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyrimidine;2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyrazine;2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyrimidine
PubChem CID162109264
Molecular FormulaC111H172F2N24O17
Molecular Weight2152.74 g/mol
Exact Mass2151.33
IUPAC Name5-(1-tert-butylpyrrolidin-3-yl)oxy-2-methoxypyridine;2-(1-tert-butylpyrrolidin-3-yl)oxypyrazine;3-fluoro-2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-fluoro-2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyrazine;3-methoxy-6-(1-propan-2-ylazetidin-3-yl)oxypyridazine;2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyrimidine;2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyrazine;2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyrimidine
SMILESCC(C)(C)N1CCC(Oc2cnccn2)C1.COc1ccc(OC2CCN(C(C)(C)C)C2)cn1.COc1ccc(OC2CN(C(C)C)C2)nn1.COc1cnc(OC2CCN(C(C)C)CC2)cn1.COc1cnc(OC2CN(C(C)C)C2)cn1.COc1ncc(OC2CCN(C(C)C)CC2)cc1F.COc1ncc(OC2CCN(C(C)C)CC2)cn1.COc1ncc(OC2CN(C(C)C)C2)cc1F.COc1ncc(OC2CN(C(C)C)C2)cn1
InChIInChI=1S/C14H21FN2O2.C14H22N2O2.2C13H21N3O2.C12H17FN2O2.C12H19N3O.3C11H17N3O2/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)16-8-7-12(10-16)18-11-5-6-13(17-4)15-9-11;1-10(2)16-6-4-11(5-7-16)18-13-9-14-12(17-3)8-15-13;1-10(2)16-6-4-11(5-7-16)18-12-8-14-13(17-3)15-9-12;1-8(2)15-6-10(7-15)17-9-4-11(13)12(16-3)14-5-9;1-12(2,3)15-7-4-10(9-15)16-11-8-13-5-6-14-11;1-8(2)14-6-9(7-14)16-11-5-12-10(15-3)4-13-11;1-8(2)14-6-10(7-14)16-9-4-12-11(15-3)13-5-9;1-8(2)14-6-9(7-14)16-11-5-4-10(15-3)12-13-11/h8-11H,4-7H2,1-3H3;5-6,9,12H,7-8,10H2,1-4H3;2*8-11H,4-7H2,1-3H3;4-5,8,10H,6-7H2,1-3H3;5-6,8,10H,4,7,9H2,1-3H3;4-5,8-9H,6-7H2,1-3H3;4-5,8,10H,6-7H2,1-3H3;4-5,8-9H,6-7H2,1-3H3
InChIKeyZFXXTYMBKMIZNQ-UHFFFAOYSA-N
XLogP14.60
TPSA379.42 Ų
H-Bond Donors
H-Bond Acceptors41
Rotatable Bonds33
Heavy Atoms154
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002152.74
LogP ≤ 514.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1041

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

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Frequently Asked Questions

What is the IUPAC name of 5-(1-tert-butylpyrrolidin-3-yl)oxy-2-methoxypyridine;2-(1-tert-butylpyrrolidin-3-yl)oxypyrazine;3-fluoro-2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-fluoro-2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyrazine;3-methoxy-6-(1-propan-2-ylazetidin-3-yl)oxypyridazine;2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyrimidine;2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyrazine;2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyrimidine?
The IUPAC name of 5-(1-tert-butylpyrrolidin-3-yl)oxy-2-methoxypyridine;2-(1-tert-butylpyrrolidin-3-yl)oxypyrazine;3-fluoro-2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-fluoro-2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyrazine;3-methoxy-6-(1-propan-2-ylazetidin-3-yl)oxypyridazine;2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyrimidine;2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyrazine;2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyrimidine (CID 162109264) is 5-(1-tert-butylpyrrolidin-3-yl)oxy-2-methoxypyridine;2-(1-tert-butylpyrrolidin-3-yl)oxypyrazine;3-fluoro-2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-fluoro-2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyrazine;3-methoxy-6-(1-propan-2-ylazetidin-3-yl)oxypyridazine;2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyrimidine;2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyrazine;2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyrimidine.
What is the SMILES notation for 5-(1-tert-butylpyrrolidin-3-yl)oxy-2-methoxypyridine;2-(1-tert-butylpyrrolidin-3-yl)oxypyrazine;3-fluoro-2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-fluoro-2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyrazine;3-methoxy-6-(1-propan-2-ylazetidin-3-yl)oxypyridazine;2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyrimidine;2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyrazine;2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyrimidine?
The canonical SMILES for 5-(1-tert-butylpyrrolidin-3-yl)oxy-2-methoxypyridine;2-(1-tert-butylpyrrolidin-3-yl)oxypyrazine;3-fluoro-2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-fluoro-2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyrazine;3-methoxy-6-(1-propan-2-ylazetidin-3-yl)oxypyridazine;2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyrimidine;2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyrazine;2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyrimidine is CC(C)(C)N1CCC(Oc2cnccn2)C1.COc1ccc(OC2CCN(C(C)(C)C)C2)cn1.COc1ccc(OC2CN(C(C)C)C2)nn1.COc1cnc(OC2CCN(C(C)C)CC2)cn1.COc1cnc(OC2CN(C(C)C)C2)cn1.COc1ncc(OC2CCN(C(C)C)CC2)cc1F.COc1ncc(OC2CCN(C(C)C)CC2)cn1.COc1ncc(OC2CN(C(C)C)C2)cc1F.COc1ncc(OC2CN(C(C)C)C2)cn1.
What is the InChIKey of 5-(1-tert-butylpyrrolidin-3-yl)oxy-2-methoxypyridine;2-(1-tert-butylpyrrolidin-3-yl)oxypyrazine;3-fluoro-2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-fluoro-2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyrazine;3-methoxy-6-(1-propan-2-ylazetidin-3-yl)oxypyridazine;2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyrimidine;2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyrazine;2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyrimidine?
The InChIKey is ZFXXTYMBKMIZNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21FN2O2.C14H22N2O2.2C13H21N3O2.C12H17FN2O2.C12H19N3O.3C11H17N3O2/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)16-8-7-12(10-16)18-11-5-6-13(17-4)15-9-11;1-10(2)16-6-4-11(5-7-16)18-13-9-14-12(17-3)8-15-13;1-10(2)16-6-4-11(5-7-16)18-12-8-14-13(17-3)15-9-12;1-8(2)15-6-10(7-15)17-9-4-11(13)12(16-3)14-5-9;1-12(2,3)15-7-4-10(9-15)16-11-8-13-5-6-14-11;1-8(2)14-6-9(7-14)16-11-5-12-10(15-3)4-13-11;1-8(2)14-6-10(7-14)16-9-4-12-11(15-3)13-5-9;1-8(2)14-6-9(7-14)16-11-5-4-10(15-3)12-13-11/h8-11H,4-7H2,1-3H3;5-6,9,12H,7-8,10H2,1-4H3;2*8-11H,4-7H2,1-3H3;4-5,8,10H,6-7H2,1-3H3;5-6,8,10H,4,7,9H2,1-3H3;4-5,8-9H,6-7H2,1-3H3;4-5,8,10H,6-7H2,1-3H3;4-5,8-9H,6-7H2,1-3H3.
What are the key properties of 5-(1-tert-butylpyrrolidin-3-yl)oxy-2-methoxypyridine;2-(1-tert-butylpyrrolidin-3-yl)oxypyrazine;3-fluoro-2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-fluoro-2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyrazine;3-methoxy-6-(1-propan-2-ylazetidin-3-yl)oxypyridazine;2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyrimidine;2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyrazine;2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyrimidine?
5-(1-tert-butylpyrrolidin-3-yl)oxy-2-methoxypyridine;2-(1-tert-butylpyrrolidin-3-yl)oxypyrazine;3-fluoro-2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-fluoro-2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyrazine;3-methoxy-6-(1-propan-2-ylazetidin-3-yl)oxypyridazine;2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyrimidine;2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyrazine;2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyrimidine has a molecular weight of 2152.74 g/mol, XLogP of 14.60, 33 rotatable bonds, 0 hydrogen bond donors, and 41 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-tert-butylpyrrolidin-3-yl)oxy-2-methoxypyridine;2-(1-tert-butylpyrrolidin-3-yl)oxypyrazine;3-fluoro-2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-fluoro-2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyrazine;3-methoxy-6-(1-propan-2-ylazetidin-3-yl)oxypyridazine;2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyrimidine;2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyrazine;2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyrimidine is sourced from PubChem (CID 162109264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).