5-chloro-2-(1-propan-2-ylpiperidin-4-yl)oxypyridine;4-(6-chloropyridazin-3-yl)oxy-1-propan-2-ylpyrrolidin-3-amine;5-ethyl-2-(1-propan-2-ylpiperidin-4-yl)oxypyridine;4-[(6-methoxy-3-pyridinyl)oxy]-1-propan-2-ylpyrrolidin-3-amine;4-(6-methylpyridazin-3-yl)oxy-1-propan-2-ylpiperidin-3-amine;2-(1-propan-2-ylpiperidin-4-yl)oxypyrimidine

C77H122Cl2N18O7 — CID 158815059

IUPAC5-chloro-2-(1-propan-2-ylpiperidin-4-yl)oxypyridine;4-(6-chloropyridazin-3-yl)oxy-1-propan-2-ylpyrrolidin-3-amine;5-ethyl-2-(1-propan-2-ylpiperidin-4-yl)oxypyridine;4-[(6-methoxy-3-pyridinyl)oxy]-1-propan-2-ylpyrrolidin-3-amine;4-(6-methylpyridazin-3-yl)oxy-1-propan-2-ylpiperidin-3-amine;2-(1-propan-2-ylpiperidin-4-yl)oxypyrimidine
SMILESCC(C)N1CC(N)C(Oc2ccc(Cl)nn2)C1.CC(C)N1CCC(Oc2ccc(Cl)cn2)CC1.CC(C)N1CCC(Oc2ncccn2)CC1.CCc1ccc(OC2CCN(C(C)C)CC2)nc1.COc1ccc(OC2CN(C(C)C)CC2N)cn1.Cc1ccc(OC2CCN(C(C)C)CC2N)nn1
InChIInChI=1S/C15H24N2O.C13H19ClN2O.C13H22N4O.C13H21N3O2.C12H19N3O.C11H17ClN4O/c1-4-13-5-6-15(16-11-13)18-14-7-9-17(10-8-14)12(2)3;1-10(2)16-7-5-12(6-8-16)17-13-4-3-11(14)9-15-13;1-9(2)17-7-6-12(11(14)8-17)18-13-5-4-10(3)15-16-13;1-9(2)16-7-11(14)12(8-16)18-10-4-5-13(17-3)15-6-10;1-10(2)15-8-4-11(5-9-15)16-12-13-6-3-7-14-12;1-7(2)16-5-8(13)9(6-16)17-11-4-3-10(12)14-15-11/h5-6,11-12,14H,4,7-10H2,1-3H3;3-4,9-10,12H,5-8H2,1-2H3;4-5,9,11-12H,6-8,14H2,1-3H3;4-6,9,11-12H,7-8,14H2,1-3H3;3,6-7,10-11H,4-5,8-9H2,1-2H3;3-4,7-9H,5-6,13H2,1-2H3
InChIKeyIVDVOXVCHNNHFW-UHFFFAOYSA-N
MW1482.85 g/mol
LogP10.40
Rot. Bonds20

About 5-chloro-2-(1-propan-2-ylpiperidin-4-yl)oxypyridine;4-(6-chloropyridazin-3-yl)oxy-1-propan-2-ylpyrrolidin-3-amine;5-ethyl-2-(1-propan-2-ylpiperidin-4-yl)oxypyridine;4-[(6-methoxy-3-pyridinyl)oxy]-1-propan-2-ylpyrrolidin-3-amine;4-(6-methylpyridazin-3-yl)oxy-1-propan-2-ylpiperidin-3-amine;2-(1-propan-2-ylpiperidin-4-yl)oxypyrimidine

5-chloro-2-(1-propan-2-ylpiperidin-4-yl)oxypyridine;4-(6-chloropyridazin-3-yl)oxy-1-propan-2-ylpyrrolidin-3-amine;5-ethyl-2-(1-propan-2-ylpiperidin-4-yl)oxypyridine;4-[(6-methoxy-3-pyridinyl)oxy]-1-propan-2-ylpyrrolidin-3-amine;4-(6-methylpyridazin-3-yl)oxy-1-propan-2-ylpiperidin-3-amine;2-(1-propan-2-ylpiperidin-4-yl)oxypyrimidine (PubChem CID 158815059) has the molecular formula C77H122Cl2N18O7 and a molecular weight of 1482.85 g/mol. Its IUPAC name is 5-chloro-2-(1-propan-2-ylpiperidin-4-yl)oxypyridine;4-(6-chloropyridazin-3-yl)oxy-1-propan-2-ylpyrrolidin-3-amine;5-ethyl-2-(1-propan-2-ylpiperidin-4-yl)oxypyridine;4-[(6-methoxy-3-pyridinyl)oxy]-1-propan-2-ylpyrrolidin-3-amine;4-(6-methylpyridazin-3-yl)oxy-1-propan-2-ylpiperidin-3-amine;2-(1-propan-2-ylpiperidin-4-yl)oxypyrimidine.

Molecular Properties

Compound Name5-chloro-2-(1-propan-2-ylpiperidin-4-yl)oxypyridine;4-(6-chloropyridazin-3-yl)oxy-1-propan-2-ylpyrrolidin-3-amine;5-ethyl-2-(1-propan-2-ylpiperidin-4-yl)oxypyridine;4-[(6-methoxy-3-pyridinyl)oxy]-1-propan-2-ylpyrrolidin-3-amine;4-(6-methylpyridazin-3-yl)oxy-1-propan-2-ylpiperidin-3-amine;2-(1-propan-2-ylpiperidin-4-yl)oxypyrimidine
PubChem CID158815059
Molecular FormulaC77H122Cl2N18O7
Molecular Weight1482.85 g/mol
Exact Mass1480.91
IUPAC Name5-chloro-2-(1-propan-2-ylpiperidin-4-yl)oxypyridine;4-(6-chloropyridazin-3-yl)oxy-1-propan-2-ylpyrrolidin-3-amine;5-ethyl-2-(1-propan-2-ylpiperidin-4-yl)oxypyridine;4-[(6-methoxy-3-pyridinyl)oxy]-1-propan-2-ylpyrrolidin-3-amine;4-(6-methylpyridazin-3-yl)oxy-1-propan-2-ylpiperidin-3-amine;2-(1-propan-2-ylpiperidin-4-yl)oxypyrimidine
SMILESCC(C)N1CC(N)C(Oc2ccc(Cl)nn2)C1.CC(C)N1CCC(Oc2ccc(Cl)cn2)CC1.CC(C)N1CCC(Oc2ncccn2)CC1.CCc1ccc(OC2CCN(C(C)C)CC2)nc1.COc1ccc(OC2CN(C(C)C)CC2N)cn1.Cc1ccc(OC2CCN(C(C)C)CC2N)nn1
InChIInChI=1S/C15H24N2O.C13H19ClN2O.C13H22N4O.C13H21N3O2.C12H19N3O.C11H17ClN4O/c1-4-13-5-6-15(16-11-13)18-14-7-9-17(10-8-14)12(2)3;1-10(2)16-7-5-12(6-8-16)17-13-4-3-11(14)9-15-13;1-9(2)17-7-6-12(11(14)8-17)18-13-5-4-10(3)15-16-13;1-9(2)16-7-11(14)12(8-16)18-10-4-5-13(17-3)15-6-10;1-10(2)15-8-4-11(5-9-15)16-12-13-6-3-7-14-12;1-7(2)16-5-8(13)9(6-16)17-11-4-3-10(12)14-15-11/h5-6,11-12,14H,4,7-10H2,1-3H3;3-4,9-10,12H,5-8H2,1-2H3;4-5,9,11-12H,6-8,14H2,1-3H3;4-6,9,11-12H,7-8,14H2,1-3H3;3,6-7,10-11H,4-5,8-9H2,1-2H3;3-4,7-9H,5-6,13H2,1-2H3
InChIKeyIVDVOXVCHNNHFW-UHFFFAOYSA-N
XLogP10.40
TPSA278.12 Ų
H-Bond Donors3
H-Bond Acceptors25
Rotatable Bonds20
Heavy Atoms104
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001482.85
LogP ≤ 510.40
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1025

Analyze 5-chloro-2-(1-propan-2-ylpiperidin-4-yl)oxypyridine;4-(6-chloropyridazin-3-yl)oxy-1-propan-2-ylpyrrolidin-3-amine;5-ethyl-2-(1-propan-2-ylpiperidin-4-yl)oxypyridine;4-[(6-methoxy-3-pyridinyl)oxy]-1-propan-2-ylpyrrolidin-3-amine;4-(6-methylpyridazin-3-yl)oxy-1-propan-2-ylpiperidin-3-amine;2-(1-propan-2-ylpiperidin-4-yl)oxypyrimidine with MolForge

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Related Compounds

US10144734, Example 498
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US10144734, Example 417
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US10144734, Example 360
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US10144734, Example 425
CID 134436178
5-Chloro-2-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-chloro-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;5-chloro-2-(1-propan-2-ylpiperidin-4-yl)oxypyridine;5-ethyl-2-(1-propan-2-ylpiperidin-4-yl)oxypyridine;5-fluoro-2-(1-propan-2-ylazetidin-3-yl)oxypyridine;5-fluoro-2-(1-propan-2-ylpiperidin-4-yl)oxypyridine;5-methoxy-2-(1-propan-2-ylazetidin-3-yl)oxypyridine;1-methyl-5-(1-propan-2-ylazetidin-3-yl)oxypyrazole;2-(3-methyl-1-propan-2-ylazetidin-3-yl)oxypyridine;3-methyl-2-(1-propan-2-ylazetidin-3-yl)oxypyridine;5-methyl-2-(1-propan-2-ylazetidin-3-yl)oxypyridine;2-(1-propan-2-ylpiperidin-4-yl)oxypyrimidine;2-(1-propan-2-ylpiperidin-4-yl)oxy-5-(trifluoromethyl)pyridine;2-(1-propan-2-ylpyrrolidin-3-yl)oxypyridine
CID 157638594
6-[6-amino-4-(trifluoromethyl)-3-pyridinyl]-2-morpholin-4-yl-N-[6-(1-propan-2-ylpiperidin-4-yl)oxy-3-pyridinyl]pyrimidin-4-amine;5-(6-chloro-2-morpholin-4-ylpyrimidin-4-yl)-4-(trifluoromethyl)pyridin-2-amine;6-(1-propan-2-ylpiperidin-4-yl)oxypyridin-3-amine
CID 159764390
4-[2-[4-(6-Chloropyrimidin-4-yl)pyrazol-1-yl]ethyl]morpholine;1-[4-chloro-3-(trifluoromethyl)phenyl]-3-[4-[6-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]pyrimidin-4-yl]oxyphenyl]urea;4,6-dichloropyrimidine;4-[6-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]pyrimidin-4-yl]oxyaniline
CID 159946108
3-tert-butyl-2-chloropyridine;3-tert-butyl-4-chloropyridine;5-tert-butyl-N,N-dimethylpyridazin-3-amine;3-tert-butyl-2-fluoropyridine;3-tert-butyl-2-methoxypyridine;3-tert-butyl-4-methoxypyridine;3-tert-butyl-5-methoxypyridine;5-tert-butyl-3-(4-methylpiperazin-1-yl)pyridazine;bis(5-tert-butyl-3-methylpyridazine);3-tert-butyl-2-methylpyridine;3-tert-butylpyridazine;2-tert-butylpyridine;3-tert-butylpyridine;1-(3-tert-butyl-4-pyridinyl)-4-methylpiperazine;4-tert-butylpyrimidin-2-amine;3-tert-butyl-2-(trifluoromethyl)pyridine;3-(2,2-dimethylpropyl)pyridine
CID 161141450
N-benzylpropan-2-amine;1-(5-chloro-2-methoxy-4-pyridinyl)-N-propan-2-ylazetidin-3-amine;1-(2-chloro-6-methyl-4-pyridinyl)-N-propan-2-ylazetidin-3-amine;1-(5-chloro-2-methyl-4-pyridinyl)-N-propan-2-ylazetidin-3-amine;1-[5-(1,1-difluoroethyl)pyrimidin-2-yl]-N-propan-2-ylazetidin-3-amine;1-[2-(1-fluoroethoxy)-6-methyl-4-pyridinyl]-N-propan-2-ylazetidin-3-amine;1-[2-(1-fluoroethoxy)-4-pyridinyl]-N-propan-2-ylazetidin-3-amine;N-[(3-fluoro-4-methoxyphenyl)methyl]propan-2-amine;N-propan-2-yl-1-(5-propan-2-yloxypyrimidin-2-yl)azetidin-3-amine;N-(pyridin-4-ylmethyl)propan-2-amine
CID 161558644
3-Chloro-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;5-chloro-2-(1-propan-2-ylpiperidin-4-yl)oxypyridine;4-(6-chloropyridazin-3-yl)oxy-1-propan-2-ylpyrrolidin-3-amine;5-ethyl-2-(1-propan-2-ylpiperidin-4-yl)oxypyridine;5-fluoro-2-(1-propan-2-ylpiperidin-4-yl)oxypyridine;3-methyl-2-(1-propan-2-ylazetidin-3-yl)oxypyridine;5-methyl-2-(1-propan-2-ylazetidin-3-yl)oxypyridine;2-(1-propan-2-ylpiperidin-4-yl)oxypyrimidine;2-(1-propan-2-ylpiperidin-4-yl)oxy-5-(trifluoromethyl)pyridine;2-(1-propan-2-ylpyrrolidin-3-yl)oxypyridine
CID 167654462
2-[5-[(3S)-3-[[2-chloro-5-[3-methoxy-5-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]oxy-2-pyridinyl]-4-pyridinyl]amino]butoxy]-1-methylpyrazol-4-yl]pyrimidin-4-amine
CID 172284069

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-(1-propan-2-ylpiperidin-4-yl)oxypyridine;4-(6-chloropyridazin-3-yl)oxy-1-propan-2-ylpyrrolidin-3-amine;5-ethyl-2-(1-propan-2-ylpiperidin-4-yl)oxypyridine;4-[(6-methoxy-3-pyridinyl)oxy]-1-propan-2-ylpyrrolidin-3-amine;4-(6-methylpyridazin-3-yl)oxy-1-propan-2-ylpiperidin-3-amine;2-(1-propan-2-ylpiperidin-4-yl)oxypyrimidine?
The IUPAC name of 5-chloro-2-(1-propan-2-ylpiperidin-4-yl)oxypyridine;4-(6-chloropyridazin-3-yl)oxy-1-propan-2-ylpyrrolidin-3-amine;5-ethyl-2-(1-propan-2-ylpiperidin-4-yl)oxypyridine;4-[(6-methoxy-3-pyridinyl)oxy]-1-propan-2-ylpyrrolidin-3-amine;4-(6-methylpyridazin-3-yl)oxy-1-propan-2-ylpiperidin-3-amine;2-(1-propan-2-ylpiperidin-4-yl)oxypyrimidine (CID 158815059) is 5-chloro-2-(1-propan-2-ylpiperidin-4-yl)oxypyridine;4-(6-chloropyridazin-3-yl)oxy-1-propan-2-ylpyrrolidin-3-amine;5-ethyl-2-(1-propan-2-ylpiperidin-4-yl)oxypyridine;4-[(6-methoxy-3-pyridinyl)oxy]-1-propan-2-ylpyrrolidin-3-amine;4-(6-methylpyridazin-3-yl)oxy-1-propan-2-ylpiperidin-3-amine;2-(1-propan-2-ylpiperidin-4-yl)oxypyrimidine.
What is the SMILES notation for 5-chloro-2-(1-propan-2-ylpiperidin-4-yl)oxypyridine;4-(6-chloropyridazin-3-yl)oxy-1-propan-2-ylpyrrolidin-3-amine;5-ethyl-2-(1-propan-2-ylpiperidin-4-yl)oxypyridine;4-[(6-methoxy-3-pyridinyl)oxy]-1-propan-2-ylpyrrolidin-3-amine;4-(6-methylpyridazin-3-yl)oxy-1-propan-2-ylpiperidin-3-amine;2-(1-propan-2-ylpiperidin-4-yl)oxypyrimidine?
The canonical SMILES for 5-chloro-2-(1-propan-2-ylpiperidin-4-yl)oxypyridine;4-(6-chloropyridazin-3-yl)oxy-1-propan-2-ylpyrrolidin-3-amine;5-ethyl-2-(1-propan-2-ylpiperidin-4-yl)oxypyridine;4-[(6-methoxy-3-pyridinyl)oxy]-1-propan-2-ylpyrrolidin-3-amine;4-(6-methylpyridazin-3-yl)oxy-1-propan-2-ylpiperidin-3-amine;2-(1-propan-2-ylpiperidin-4-yl)oxypyrimidine is CC(C)N1CC(N)C(Oc2ccc(Cl)nn2)C1.CC(C)N1CCC(Oc2ccc(Cl)cn2)CC1.CC(C)N1CCC(Oc2ncccn2)CC1.CCc1ccc(OC2CCN(C(C)C)CC2)nc1.COc1ccc(OC2CN(C(C)C)CC2N)cn1.Cc1ccc(OC2CCN(C(C)C)CC2N)nn1.
What is the InChIKey of 5-chloro-2-(1-propan-2-ylpiperidin-4-yl)oxypyridine;4-(6-chloropyridazin-3-yl)oxy-1-propan-2-ylpyrrolidin-3-amine;5-ethyl-2-(1-propan-2-ylpiperidin-4-yl)oxypyridine;4-[(6-methoxy-3-pyridinyl)oxy]-1-propan-2-ylpyrrolidin-3-amine;4-(6-methylpyridazin-3-yl)oxy-1-propan-2-ylpiperidin-3-amine;2-(1-propan-2-ylpiperidin-4-yl)oxypyrimidine?
The InChIKey is IVDVOXVCHNNHFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O.C13H19ClN2O.C13H22N4O.C13H21N3O2.C12H19N3O.C11H17ClN4O/c1-4-13-5-6-15(16-11-13)18-14-7-9-17(10-8-14)12(2)3;1-10(2)16-7-5-12(6-8-16)17-13-4-3-11(14)9-15-13;1-9(2)17-7-6-12(11(14)8-17)18-13-5-4-10(3)15-16-13;1-9(2)16-7-11(14)12(8-16)18-10-4-5-13(17-3)15-6-10;1-10(2)15-8-4-11(5-9-15)16-12-13-6-3-7-14-12;1-7(2)16-5-8(13)9(6-16)17-11-4-3-10(12)14-15-11/h5-6,11-12,14H,4,7-10H2,1-3H3;3-4,9-10,12H,5-8H2,1-2H3;4-5,9,11-12H,6-8,14H2,1-3H3;4-6,9,11-12H,7-8,14H2,1-3H3;3,6-7,10-11H,4-5,8-9H2,1-2H3;3-4,7-9H,5-6,13H2,1-2H3.
What are the key properties of 5-chloro-2-(1-propan-2-ylpiperidin-4-yl)oxypyridine;4-(6-chloropyridazin-3-yl)oxy-1-propan-2-ylpyrrolidin-3-amine;5-ethyl-2-(1-propan-2-ylpiperidin-4-yl)oxypyridine;4-[(6-methoxy-3-pyridinyl)oxy]-1-propan-2-ylpyrrolidin-3-amine;4-(6-methylpyridazin-3-yl)oxy-1-propan-2-ylpiperidin-3-amine;2-(1-propan-2-ylpiperidin-4-yl)oxypyrimidine?
5-chloro-2-(1-propan-2-ylpiperidin-4-yl)oxypyridine;4-(6-chloropyridazin-3-yl)oxy-1-propan-2-ylpyrrolidin-3-amine;5-ethyl-2-(1-propan-2-ylpiperidin-4-yl)oxypyridine;4-[(6-methoxy-3-pyridinyl)oxy]-1-propan-2-ylpyrrolidin-3-amine;4-(6-methylpyridazin-3-yl)oxy-1-propan-2-ylpiperidin-3-amine;2-(1-propan-2-ylpiperidin-4-yl)oxypyrimidine has a molecular weight of 1482.85 g/mol, XLogP of 10.40, 20 rotatable bonds, 3 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-(1-propan-2-ylpiperidin-4-yl)oxypyridine;4-(6-chloropyridazin-3-yl)oxy-1-propan-2-ylpyrrolidin-3-amine;5-ethyl-2-(1-propan-2-ylpiperidin-4-yl)oxypyridine;4-[(6-methoxy-3-pyridinyl)oxy]-1-propan-2-ylpyrrolidin-3-amine;4-(6-methylpyridazin-3-yl)oxy-1-propan-2-ylpiperidin-3-amine;2-(1-propan-2-ylpiperidin-4-yl)oxypyrimidine is sourced from PubChem (CID 158815059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).