5-tert-butyl-2-(2-methoxyethoxy)pyridine;5-tert-butyl-N-(2-methoxyethyl)-N-methylpyridin-2-amine;5-tert-butyl-2-[(1-methylpiperidin-4-yl)methoxy]pyridine;5-tert-butyl-2-(3-methylsulfonylpropoxy)pyridine;2-(3-tert-butylphenoxy)ethanol;2-(3-tert-butylphenoxy)-2-methylpropan-1-ol;2-[4-(3-tert-butylphenyl)piperazin-1-yl]ethanol;5-tert-butyl-2-propan-2-yloxypyridine;5-tert-butyl-2-(trideuteriomethoxy)pyridine

C118H188N10O14S — CID 159237123

IUPAC5-tert-butyl-2-(2-methoxyethoxy)pyridine;5-tert-butyl-N-(2-methoxyethyl)-N-methylpyridin-2-amine;5-tert-butyl-2-[(1-methylpiperidin-4-yl)methoxy]pyridine;5-tert-butyl-2-(3-methylsulfonylpropoxy)pyridine;2-(3-tert-butylphenoxy)ethanol;2-(3-tert-butylphenoxy)-2-methylpropan-1-ol;2-[4-(3-tert-butylphenyl)piperazin-1-yl]ethanol;5-tert-butyl-2-propan-2-yloxypyridine;5-tert-butyl-2-(trideuteriomethoxy)pyridine
SMILESCC(C)(C)c1ccc(OCCCS(C)(=O)=O)nc1.CC(C)(C)c1cccc(N2CCN(CCO)CC2)c1.CC(C)(C)c1cccc(OCCO)c1.CC(C)(CO)Oc1cccc(C(C)(C)C)c1.CC(C)Oc1ccc(C(C)(C)C)cn1.CN1CCC(COc2ccc(C(C)(C)C)cn2)CC1.COCCN(C)c1ccc(C(C)(C)C)cn1.COCCOc1ccc(C(C)(C)C)cn1.[2H]C([2H])([2H])Oc1ccc(C(C)(C)C)cn1
InChIInChI=1S/2C16H26N2O.C14H22O2.C13H22N2O.C13H21NO3S.C12H19NO2.C12H19NO.C12H18O2.C10H15NO/c1-16(2,3)14-5-6-15(17-11-14)19-12-13-7-9-18(4)10-8-13;1-16(2,3)14-5-4-6-15(13-14)18-9-7-17(8-10-18)11-12-19;1-13(2,3)11-7-6-8-12(9-11)16-14(4,5)10-15;1-13(2,3)11-6-7-12(14-10-11)15(4)8-9-16-5;1-13(2,3)11-6-7-12(14-10-11)17-8-5-9-18(4,15)16;1-12(2,3)10-5-6-11(13-9-10)15-8-7-14-4;1-9(2)14-11-7-6-10(8-13-11)12(3,4)5;1-12(2,3)10-5-4-6-11(9-10)14-8-7-13;1-10(2,3)8-5-6-9(12-4)11-7-8/h5-6,11,13H,7-10,12H2,1-4H3;4-6,13,19H,7-12H2,1-3H3;6-9,15H,10H2,1-5H3;6-7,10H,8-9H2,1-5H3;6-7,10H,5,8-9H2,1-4H3;5-6,9H,7-8H2,1-4H3;6-9H,1-5H3;4-6,9,13H,7-8H2,1-3H3;5-7H,1-4H3/i;;;;;;;;4D3
InChIKeyKTPSMKCJXVZYAK-LOGWUITPSA-N
MW2005.94 g/mol
LogP23.30
Rot. Bonds29

About 5-tert-butyl-2-(2-methoxyethoxy)pyridine;5-tert-butyl-N-(2-methoxyethyl)-N-methylpyridin-2-amine;5-tert-butyl-2-[(1-methylpiperidin-4-yl)methoxy]pyridine;5-tert-butyl-2-(3-methylsulfonylpropoxy)pyridine;2-(3-tert-butylphenoxy)ethanol;2-(3-tert-butylphenoxy)-2-methylpropan-1-ol;2-[4-(3-tert-butylphenyl)piperazin-1-yl]ethanol;5-tert-butyl-2-propan-2-yloxypyridine;5-tert-butyl-2-(trideuteriomethoxy)pyridine

5-tert-butyl-2-(2-methoxyethoxy)pyridine;5-tert-butyl-N-(2-methoxyethyl)-N-methylpyridin-2-amine;5-tert-butyl-2-[(1-methylpiperidin-4-yl)methoxy]pyridine;5-tert-butyl-2-(3-methylsulfonylpropoxy)pyridine;2-(3-tert-butylphenoxy)ethanol;2-(3-tert-butylphenoxy)-2-methylpropan-1-ol;2-[4-(3-tert-butylphenyl)piperazin-1-yl]ethanol;5-tert-butyl-2-propan-2-yloxypyridine;5-tert-butyl-2-(trideuteriomethoxy)pyridine (PubChem CID 159237123) has the molecular formula C118H188N10O14S and a molecular weight of 2005.94 g/mol. Its IUPAC name is 5-tert-butyl-2-(2-methoxyethoxy)pyridine;5-tert-butyl-N-(2-methoxyethyl)-N-methylpyridin-2-amine;5-tert-butyl-2-[(1-methylpiperidin-4-yl)methoxy]pyridine;5-tert-butyl-2-(3-methylsulfonylpropoxy)pyridine;2-(3-tert-butylphenoxy)ethanol;2-(3-tert-butylphenoxy)-2-methylpropan-1-ol;2-[4-(3-tert-butylphenyl)piperazin-1-yl]ethanol;5-tert-butyl-2-propan-2-yloxypyridine;5-tert-butyl-2-(trideuteriomethoxy)pyridine.

Molecular Properties

Compound Name5-tert-butyl-2-(2-methoxyethoxy)pyridine;5-tert-butyl-N-(2-methoxyethyl)-N-methylpyridin-2-amine;5-tert-butyl-2-[(1-methylpiperidin-4-yl)methoxy]pyridine;5-tert-butyl-2-(3-methylsulfonylpropoxy)pyridine;2-(3-tert-butylphenoxy)ethanol;2-(3-tert-butylphenoxy)-2-methylpropan-1-ol;2-[4-(3-tert-butylphenyl)piperazin-1-yl]ethanol;5-tert-butyl-2-propan-2-yloxypyridine;5-tert-butyl-2-(trideuteriomethoxy)pyridine
PubChem CID159237123
Molecular FormulaC118H188N10O14S
Molecular Weight2005.94 g/mol
Exact Mass2004.42
IUPAC Name5-tert-butyl-2-(2-methoxyethoxy)pyridine;5-tert-butyl-N-(2-methoxyethyl)-N-methylpyridin-2-amine;5-tert-butyl-2-[(1-methylpiperidin-4-yl)methoxy]pyridine;5-tert-butyl-2-(3-methylsulfonylpropoxy)pyridine;2-(3-tert-butylphenoxy)ethanol;2-(3-tert-butylphenoxy)-2-methylpropan-1-ol;2-[4-(3-tert-butylphenyl)piperazin-1-yl]ethanol;5-tert-butyl-2-propan-2-yloxypyridine;5-tert-butyl-2-(trideuteriomethoxy)pyridine
SMILESCC(C)(C)c1ccc(OCCCS(C)(=O)=O)nc1.CC(C)(C)c1cccc(N2CCN(CCO)CC2)c1.CC(C)(C)c1cccc(OCCO)c1.CC(C)(CO)Oc1cccc(C(C)(C)C)c1.CC(C)Oc1ccc(C(C)(C)C)cn1.CN1CCC(COc2ccc(C(C)(C)C)cn2)CC1.COCCN(C)c1ccc(C(C)(C)C)cn1.COCCOc1ccc(C(C)(C)C)cn1.[2H]C([2H])([2H])Oc1ccc(C(C)(C)C)cn1
InChIInChI=1S/2C16H26N2O.C14H22O2.C13H22N2O.C13H21NO3S.C12H19NO2.C12H19NO.C12H18O2.C10H15NO/c1-16(2,3)14-5-6-15(17-11-14)19-12-13-7-9-18(4)10-8-13;1-16(2,3)14-5-4-6-15(13-14)18-9-7-17(8-10-18)11-12-19;1-13(2,3)11-7-6-8-12(9-11)16-14(4,5)10-15;1-13(2,3)11-6-7-12(14-10-11)15(4)8-9-16-5;1-13(2,3)11-6-7-12(14-10-11)17-8-5-9-18(4,15)16;1-12(2,3)10-5-6-11(13-9-10)15-8-7-14-4;1-9(2)14-11-7-6-10(8-13-11)12(3,4)5;1-12(2,3)10-5-4-6-11(9-10)14-8-7-13;1-10(2,3)8-5-6-9(12-4)11-7-8/h5-6,11,13H,7-10,12H2,1-4H3;4-6,13,19H,7-12H2,1-3H3;6-9,15H,10H2,1-5H3;6-7,10H,8-9H2,1-5H3;6-7,10H,5,8-9H2,1-4H3;5-6,9H,7-8H2,1-4H3;6-9H,1-5H3;4-6,9,13H,7-8H2,1-3H3;5-7H,1-4H3/i;;;;;;;;4D3
InChIKeyKTPSMKCJXVZYAK-LOGWUITPSA-N
XLogP23.30
TPSA268.20 Ų
H-Bond Donors3
H-Bond Acceptors24
Rotatable Bonds29
Heavy Atoms143
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002005.94
LogP ≤ 523.30
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1024

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 5-tert-butyl-2-(2-methoxyethoxy)pyridine;5-tert-butyl-N-(2-methoxyethyl)-N-methylpyridin-2-amine;5-tert-butyl-2-[(1-methylpiperidin-4-yl)methoxy]pyridine;5-tert-butyl-2-(3-methylsulfonylpropoxy)pyridine;2-(3-tert-butylphenoxy)ethanol;2-(3-tert-butylphenoxy)-2-methylpropan-1-ol;2-[4-(3-tert-butylphenyl)piperazin-1-yl]ethanol;5-tert-butyl-2-propan-2-yloxypyridine;5-tert-butyl-2-(trideuteriomethoxy)pyridine with MolForge

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Related Compounds

1-(3-methoxyphenyl)-4-[(1-methylpiperidin-4-yl)methyl]piperazine
CID 171069764
2-[4-[3-(trifluoromethoxy)phenyl]piperazin-1-yl]ethanol
CID 11972047
1-tert-butyl-4-[3-(3-tert-butylphenoxy)propyl]piperazine
CID 135165094
1-[3-(azetidin-1-yl)phenyl]-4-[6-[2-methoxyethyl(methyl)amino]-3-pyridinyl]-3-propan-2-ylpyrazolo[5,4-b]pyridine-6-carboxylic acid
CID 126743124
N-(2-methoxyethyl)-N-methyl-5-[[[(2R)-1-(4-phenylpiperazin-1-yl)propan-2-yl]amino]methyl]pyridin-2-amine
CID 124847594
3-[2-[4-(methoxymethyl)piperidin-1-yl]ethoxy]benzoic acid
CID 63971546
[1-[3-(3-tert-butylphenoxy)propyl]pyrrolidin-2-yl]methanol
CID 20619549
3-[3-[5-(4-methylpiperazin-1-yl)pentoxy]phenyl]-1,3-thiazolidine-2,4-dione
CID 142712223
[3-(2-methoxyethoxy)phenyl]-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methanone
CID 55997430
2-[(1-methylpiperidin-4-yl)methoxy]-5-propan-2-ylpyridine
CID 129028091
1-[[3-[2-[2-methoxyethyl(methyl)amino]ethoxy]phenyl]methyl]-3-[3-(4-pyridin-4-ylpiperazin-1-yl)propyl]urea;2,2,2-trifluoroacetic acid
CID 167976048
[6-[2-methoxyethyl(methyl)amino]-3-pyridinyl]-[(3R)-3-(methoxymethyl)piperidin-1-yl]methanone
CID 28956848

Frequently Asked Questions

What is the IUPAC name of 5-tert-butyl-2-(2-methoxyethoxy)pyridine;5-tert-butyl-N-(2-methoxyethyl)-N-methylpyridin-2-amine;5-tert-butyl-2-[(1-methylpiperidin-4-yl)methoxy]pyridine;5-tert-butyl-2-(3-methylsulfonylpropoxy)pyridine;2-(3-tert-butylphenoxy)ethanol;2-(3-tert-butylphenoxy)-2-methylpropan-1-ol;2-[4-(3-tert-butylphenyl)piperazin-1-yl]ethanol;5-tert-butyl-2-propan-2-yloxypyridine;5-tert-butyl-2-(trideuteriomethoxy)pyridine?
The IUPAC name of 5-tert-butyl-2-(2-methoxyethoxy)pyridine;5-tert-butyl-N-(2-methoxyethyl)-N-methylpyridin-2-amine;5-tert-butyl-2-[(1-methylpiperidin-4-yl)methoxy]pyridine;5-tert-butyl-2-(3-methylsulfonylpropoxy)pyridine;2-(3-tert-butylphenoxy)ethanol;2-(3-tert-butylphenoxy)-2-methylpropan-1-ol;2-[4-(3-tert-butylphenyl)piperazin-1-yl]ethanol;5-tert-butyl-2-propan-2-yloxypyridine;5-tert-butyl-2-(trideuteriomethoxy)pyridine (CID 159237123) is 5-tert-butyl-2-(2-methoxyethoxy)pyridine;5-tert-butyl-N-(2-methoxyethyl)-N-methylpyridin-2-amine;5-tert-butyl-2-[(1-methylpiperidin-4-yl)methoxy]pyridine;5-tert-butyl-2-(3-methylsulfonylpropoxy)pyridine;2-(3-tert-butylphenoxy)ethanol;2-(3-tert-butylphenoxy)-2-methylpropan-1-ol;2-[4-(3-tert-butylphenyl)piperazin-1-yl]ethanol;5-tert-butyl-2-propan-2-yloxypyridine;5-tert-butyl-2-(trideuteriomethoxy)pyridine.
What is the SMILES notation for 5-tert-butyl-2-(2-methoxyethoxy)pyridine;5-tert-butyl-N-(2-methoxyethyl)-N-methylpyridin-2-amine;5-tert-butyl-2-[(1-methylpiperidin-4-yl)methoxy]pyridine;5-tert-butyl-2-(3-methylsulfonylpropoxy)pyridine;2-(3-tert-butylphenoxy)ethanol;2-(3-tert-butylphenoxy)-2-methylpropan-1-ol;2-[4-(3-tert-butylphenyl)piperazin-1-yl]ethanol;5-tert-butyl-2-propan-2-yloxypyridine;5-tert-butyl-2-(trideuteriomethoxy)pyridine?
The canonical SMILES for 5-tert-butyl-2-(2-methoxyethoxy)pyridine;5-tert-butyl-N-(2-methoxyethyl)-N-methylpyridin-2-amine;5-tert-butyl-2-[(1-methylpiperidin-4-yl)methoxy]pyridine;5-tert-butyl-2-(3-methylsulfonylpropoxy)pyridine;2-(3-tert-butylphenoxy)ethanol;2-(3-tert-butylphenoxy)-2-methylpropan-1-ol;2-[4-(3-tert-butylphenyl)piperazin-1-yl]ethanol;5-tert-butyl-2-propan-2-yloxypyridine;5-tert-butyl-2-(trideuteriomethoxy)pyridine is CC(C)(C)c1ccc(OCCCS(C)(=O)=O)nc1.CC(C)(C)c1cccc(N2CCN(CCO)CC2)c1.CC(C)(C)c1cccc(OCCO)c1.CC(C)(CO)Oc1cccc(C(C)(C)C)c1.CC(C)Oc1ccc(C(C)(C)C)cn1.CN1CCC(COc2ccc(C(C)(C)C)cn2)CC1.COCCN(C)c1ccc(C(C)(C)C)cn1.COCCOc1ccc(C(C)(C)C)cn1.[2H]C([2H])([2H])Oc1ccc(C(C)(C)C)cn1.
What is the InChIKey of 5-tert-butyl-2-(2-methoxyethoxy)pyridine;5-tert-butyl-N-(2-methoxyethyl)-N-methylpyridin-2-amine;5-tert-butyl-2-[(1-methylpiperidin-4-yl)methoxy]pyridine;5-tert-butyl-2-(3-methylsulfonylpropoxy)pyridine;2-(3-tert-butylphenoxy)ethanol;2-(3-tert-butylphenoxy)-2-methylpropan-1-ol;2-[4-(3-tert-butylphenyl)piperazin-1-yl]ethanol;5-tert-butyl-2-propan-2-yloxypyridine;5-tert-butyl-2-(trideuteriomethoxy)pyridine?
The InChIKey is KTPSMKCJXVZYAK-LOGWUITPSA-N. The full InChI is InChI=1S/2C16H26N2O.C14H22O2.C13H22N2O.C13H21NO3S.C12H19NO2.C12H19NO.C12H18O2.C10H15NO/c1-16(2,3)14-5-6-15(17-11-14)19-12-13-7-9-18(4)10-8-13;1-16(2,3)14-5-4-6-15(13-14)18-9-7-17(8-10-18)11-12-19;1-13(2,3)11-7-6-8-12(9-11)16-14(4,5)10-15;1-13(2,3)11-6-7-12(14-10-11)15(4)8-9-16-5;1-13(2,3)11-6-7-12(14-10-11)17-8-5-9-18(4,15)16;1-12(2,3)10-5-6-11(13-9-10)15-8-7-14-4;1-9(2)14-11-7-6-10(8-13-11)12(3,4)5;1-12(2,3)10-5-4-6-11(9-10)14-8-7-13;1-10(2,3)8-5-6-9(12-4)11-7-8/h5-6,11,13H,7-10,12H2,1-4H3;4-6,13,19H,7-12H2,1-3H3;6-9,15H,10H2,1-5H3;6-7,10H,8-9H2,1-5H3;6-7,10H,5,8-9H2,1-4H3;5-6,9H,7-8H2,1-4H3;6-9H,1-5H3;4-6,9,13H,7-8H2,1-3H3;5-7H,1-4H3/i;;;;;;;;4D3.
What are the key properties of 5-tert-butyl-2-(2-methoxyethoxy)pyridine;5-tert-butyl-N-(2-methoxyethyl)-N-methylpyridin-2-amine;5-tert-butyl-2-[(1-methylpiperidin-4-yl)methoxy]pyridine;5-tert-butyl-2-(3-methylsulfonylpropoxy)pyridine;2-(3-tert-butylphenoxy)ethanol;2-(3-tert-butylphenoxy)-2-methylpropan-1-ol;2-[4-(3-tert-butylphenyl)piperazin-1-yl]ethanol;5-tert-butyl-2-propan-2-yloxypyridine;5-tert-butyl-2-(trideuteriomethoxy)pyridine?
5-tert-butyl-2-(2-methoxyethoxy)pyridine;5-tert-butyl-N-(2-methoxyethyl)-N-methylpyridin-2-amine;5-tert-butyl-2-[(1-methylpiperidin-4-yl)methoxy]pyridine;5-tert-butyl-2-(3-methylsulfonylpropoxy)pyridine;2-(3-tert-butylphenoxy)ethanol;2-(3-tert-butylphenoxy)-2-methylpropan-1-ol;2-[4-(3-tert-butylphenyl)piperazin-1-yl]ethanol;5-tert-butyl-2-propan-2-yloxypyridine;5-tert-butyl-2-(trideuteriomethoxy)pyridine has a molecular weight of 2005.94 g/mol, XLogP of 23.30, 29 rotatable bonds, 3 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for 5-tert-butyl-2-(2-methoxyethoxy)pyridine;5-tert-butyl-N-(2-methoxyethyl)-N-methylpyridin-2-amine;5-tert-butyl-2-[(1-methylpiperidin-4-yl)methoxy]pyridine;5-tert-butyl-2-(3-methylsulfonylpropoxy)pyridine;2-(3-tert-butylphenoxy)ethanol;2-(3-tert-butylphenoxy)-2-methylpropan-1-ol;2-[4-(3-tert-butylphenyl)piperazin-1-yl]ethanol;5-tert-butyl-2-propan-2-yloxypyridine;5-tert-butyl-2-(trideuteriomethoxy)pyridine is sourced from PubChem (CID 159237123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).