2-tert-butyl-6-ethoxypyridine;2-tert-butyl-6-ethylpyridine;2-tert-butyl-6-methoxy-4-methylpyridine;2-tert-butyl-6-methylpyridine;3-tert-butyl-5-methylpyridine;3-tert-butylpyridine;(6-tert-butyl-2-pyridinyl)methanol;2-[(6-tert-butyl-2-pyridinyl)oxy]ethanol;2-tert-butyl-6-(3,3,3-trifluoropropyl)pyridine

C95H142F3N9O5 — CID 159567709

IUPAC2-tert-butyl-6-ethoxypyridine;2-tert-butyl-6-ethylpyridine;2-tert-butyl-6-methoxy-4-methylpyridine;2-tert-butyl-6-methylpyridine;3-tert-butyl-5-methylpyridine;3-tert-butylpyridine;(6-tert-butyl-2-pyridinyl)methanol;2-[(6-tert-butyl-2-pyridinyl)oxy]ethanol;2-tert-butyl-6-(3,3,3-trifluoropropyl)pyridine
SMILESCC(C)(C)c1cccc(CCC(F)(F)F)n1.CC(C)(C)c1cccc(CO)n1.CC(C)(C)c1cccc(OCCO)n1.CC(C)(C)c1cccnc1.CCOc1cccc(C(C)(C)C)n1.CCc1cccc(C(C)(C)C)n1.COc1cc(C)cc(C(C)(C)C)n1.Cc1cccc(C(C)(C)C)n1.Cc1cncc(C(C)(C)C)c1
InChIInChI=1S/C12H16F3N.C11H17NO2.2C11H17NO.C11H17N.C10H15NO.2C10H15N.C9H13N/c1-11(2,3)10-6-4-5-9(16-10)7-8-12(13,14)15;1-11(2,3)9-5-4-6-10(12-9)14-8-7-13;1-8-6-9(11(2,3)4)12-10(7-8)13-5;1-5-13-10-8-6-7-9(12-10)11(2,3)4;1-5-9-7-6-8-10(12-9)11(2,3)4;1-10(2,3)9-6-4-5-8(7-12)11-9;1-8-5-9(7-11-6-8)10(2,3)4;1-8-6-5-7-9(11-8)10(2,3)4;1-9(2,3)8-5-4-6-10-7-8/h4-6H,7-8H2,1-3H3;4-6,13H,7-8H2,1-3H3;6-7H,1-5H3;6-8H,5H2,1-4H3;6-8H,5H2,1-4H3;4-6,12H,7H2,1-3H3;2*5-7H,1-4H3;4-7H,1-3H3
InChIKeyMHKIWQVSGWBDAO-UHFFFAOYSA-N
MW1547.23 g/mol
LogP23.67
Rot. Bonds10

About 2-tert-butyl-6-ethoxypyridine;2-tert-butyl-6-ethylpyridine;2-tert-butyl-6-methoxy-4-methylpyridine;2-tert-butyl-6-methylpyridine;3-tert-butyl-5-methylpyridine;3-tert-butylpyridine;(6-tert-butyl-2-pyridinyl)methanol;2-[(6-tert-butyl-2-pyridinyl)oxy]ethanol;2-tert-butyl-6-(3,3,3-trifluoropropyl)pyridine

2-tert-butyl-6-ethoxypyridine;2-tert-butyl-6-ethylpyridine;2-tert-butyl-6-methoxy-4-methylpyridine;2-tert-butyl-6-methylpyridine;3-tert-butyl-5-methylpyridine;3-tert-butylpyridine;(6-tert-butyl-2-pyridinyl)methanol;2-[(6-tert-butyl-2-pyridinyl)oxy]ethanol;2-tert-butyl-6-(3,3,3-trifluoropropyl)pyridine (PubChem CID 159567709) has the molecular formula C95H142F3N9O5 and a molecular weight of 1547.23 g/mol. Its IUPAC name is 2-tert-butyl-6-ethoxypyridine;2-tert-butyl-6-ethylpyridine;2-tert-butyl-6-methoxy-4-methylpyridine;2-tert-butyl-6-methylpyridine;3-tert-butyl-5-methylpyridine;3-tert-butylpyridine;(6-tert-butyl-2-pyridinyl)methanol;2-[(6-tert-butyl-2-pyridinyl)oxy]ethanol;2-tert-butyl-6-(3,3,3-trifluoropropyl)pyridine.

Molecular Properties

Compound Name2-tert-butyl-6-ethoxypyridine;2-tert-butyl-6-ethylpyridine;2-tert-butyl-6-methoxy-4-methylpyridine;2-tert-butyl-6-methylpyridine;3-tert-butyl-5-methylpyridine;3-tert-butylpyridine;(6-tert-butyl-2-pyridinyl)methanol;2-[(6-tert-butyl-2-pyridinyl)oxy]ethanol;2-tert-butyl-6-(3,3,3-trifluoropropyl)pyridine
PubChem CID159567709
Molecular FormulaC95H142F3N9O5
Molecular Weight1547.23 g/mol
Exact Mass1546.11
IUPAC Name2-tert-butyl-6-ethoxypyridine;2-tert-butyl-6-ethylpyridine;2-tert-butyl-6-methoxy-4-methylpyridine;2-tert-butyl-6-methylpyridine;3-tert-butyl-5-methylpyridine;3-tert-butylpyridine;(6-tert-butyl-2-pyridinyl)methanol;2-[(6-tert-butyl-2-pyridinyl)oxy]ethanol;2-tert-butyl-6-(3,3,3-trifluoropropyl)pyridine
SMILESCC(C)(C)c1cccc(CCC(F)(F)F)n1.CC(C)(C)c1cccc(CO)n1.CC(C)(C)c1cccc(OCCO)n1.CC(C)(C)c1cccnc1.CCOc1cccc(C(C)(C)C)n1.CCc1cccc(C(C)(C)C)n1.COc1cc(C)cc(C(C)(C)C)n1.Cc1cccc(C(C)(C)C)n1.Cc1cncc(C(C)(C)C)c1
InChIInChI=1S/C12H16F3N.C11H17NO2.2C11H17NO.C11H17N.C10H15NO.2C10H15N.C9H13N/c1-11(2,3)10-6-4-5-9(16-10)7-8-12(13,14)15;1-11(2,3)9-5-4-6-10(12-9)14-8-7-13;1-8-6-9(11(2,3)4)12-10(7-8)13-5;1-5-13-10-8-6-7-9(12-10)11(2,3)4;1-5-9-7-6-8-10(12-9)11(2,3)4;1-10(2,3)9-6-4-5-8(7-12)11-9;1-8-5-9(7-11-6-8)10(2,3)4;1-8-6-5-7-9(11-8)10(2,3)4;1-9(2,3)8-5-4-6-10-7-8/h4-6H,7-8H2,1-3H3;4-6,13H,7-8H2,1-3H3;6-7H,1-5H3;6-8H,5H2,1-4H3;6-8H,5H2,1-4H3;4-6,12H,7H2,1-3H3;2*5-7H,1-4H3;4-7H,1-3H3
InChIKeyMHKIWQVSGWBDAO-UHFFFAOYSA-N
XLogP23.67
TPSA184.16 Ų
H-Bond Donors2
H-Bond Acceptors14
Rotatable Bonds10
Heavy Atoms112
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001547.23
LogP ≤ 523.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1014

Analyze 2-tert-butyl-6-ethoxypyridine;2-tert-butyl-6-ethylpyridine;2-tert-butyl-6-methoxy-4-methylpyridine;2-tert-butyl-6-methylpyridine;3-tert-butyl-5-methylpyridine;3-tert-butylpyridine;(6-tert-butyl-2-pyridinyl)methanol;2-[(6-tert-butyl-2-pyridinyl)oxy]ethanol;2-tert-butyl-6-(3,3,3-trifluoropropyl)pyridine with MolForge

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Launch Full Analysis

Related Compounds

2-Methoxy-3-[2-[[6-[6-(2,2,2-trifluoroethoxy)pyridin-3-yl]pyridin-2-yl]methyl]phenyl]pyridine
CID 118073516
[5-[[6-(2,2-Difluoroethoxy)-5-(2-ethoxypyridin-4-yl)pyridin-3-yl]methyl]-3-fluoropyridin-2-yl]methanol
CID 117604405
[5-[[5-[2-(Difluoromethoxy)pyridin-4-yl]-6-ethoxypyridin-3-yl]methyl]-3-fluoropyridin-2-yl]methanol
CID 117604774
2,2-Dimethyl-1-pyrazin-2-yl-1-[5-[6-(2,2,2-trifluoroethoxy)pyridin-3-yl]pyridin-2-yl]propan-1-ol
CID 118443813
3,3-Dimethyl-1-pyridin-3-yl-2-[5-[6-(2,2,2-trifluoroethoxy)pyridin-3-yl]pyridin-2-yl]butan-2-ol
CID 118443854
2-[5-[6-(2-Fluoroethoxy)-3-pyridinyl]-2-pyridinyl]-3,3-dimethyl-1-pyridin-3-ylbutan-2-ol
CID 118447771
[5-[[5-[2-(Difluoromethoxy)-4-pyridinyl]-6-ethoxy-2-propyl-3-pyridinyl]methyl]-3-fluoro-2-pyridinyl]methanol
CID 123391148
[5-[5-[2-[3-(2-Ethoxy-5-fluoro-4-pyridinyl)-6-(hydroxymethyl)pyrazin-2-yl]ethyl]-2-methoxy-4-pyridinyl]-6-methylpyrazin-2-yl]methanol
CID 142593676
2-(4-Methoxyphenyl)-6-[(4-phenylpiperidin-4-yl)methoxymethyl]-4-(trifluoromethyl)pyridine;2-[(4-phenylpiperidin-4-yl)methoxymethyl]-6-pyridin-4-yl-4-(trifluoromethyl)pyridine
CID 143618652
2-[[1-Methyl-4-[4-[[4-[6-[(1-methyl-4-phenylpiperidin-4-yl)methoxymethyl]-4-(trifluoromethyl)pyridin-2-yl]phenoxy]methyl]phenyl]piperidin-4-yl]methoxymethyl]-6-pyridin-4-yl-4-(trifluoromethyl)pyridine
CID 143618655
2-(1,1-Difluoro-2-methoxyethyl)-5-[[3-(4-fluoro-2-methoxyphenyl)-2-pyridinyl]oxy]pyridine;2-(1,1-difluoro-2-methoxyethyl)-5-[[3-(2-methoxyphenyl)-2-pyridinyl]oxy]pyridine;ethane
CID 145276172
N-[4-(5-cyano-6-methoxy-4-pyridin-2-yl-2-pyridinyl)phenyl]-4-(4-fluorophenyl)-2-(2-hydroxyethoxy)-6-pyridin-2-ylpyridine-3-carbonitrilium
CID 154644706

Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-6-ethoxypyridine;2-tert-butyl-6-ethylpyridine;2-tert-butyl-6-methoxy-4-methylpyridine;2-tert-butyl-6-methylpyridine;3-tert-butyl-5-methylpyridine;3-tert-butylpyridine;(6-tert-butyl-2-pyridinyl)methanol;2-[(6-tert-butyl-2-pyridinyl)oxy]ethanol;2-tert-butyl-6-(3,3,3-trifluoropropyl)pyridine?
The IUPAC name of 2-tert-butyl-6-ethoxypyridine;2-tert-butyl-6-ethylpyridine;2-tert-butyl-6-methoxy-4-methylpyridine;2-tert-butyl-6-methylpyridine;3-tert-butyl-5-methylpyridine;3-tert-butylpyridine;(6-tert-butyl-2-pyridinyl)methanol;2-[(6-tert-butyl-2-pyridinyl)oxy]ethanol;2-tert-butyl-6-(3,3,3-trifluoropropyl)pyridine (CID 159567709) is 2-tert-butyl-6-ethoxypyridine;2-tert-butyl-6-ethylpyridine;2-tert-butyl-6-methoxy-4-methylpyridine;2-tert-butyl-6-methylpyridine;3-tert-butyl-5-methylpyridine;3-tert-butylpyridine;(6-tert-butyl-2-pyridinyl)methanol;2-[(6-tert-butyl-2-pyridinyl)oxy]ethanol;2-tert-butyl-6-(3,3,3-trifluoropropyl)pyridine.
What is the SMILES notation for 2-tert-butyl-6-ethoxypyridine;2-tert-butyl-6-ethylpyridine;2-tert-butyl-6-methoxy-4-methylpyridine;2-tert-butyl-6-methylpyridine;3-tert-butyl-5-methylpyridine;3-tert-butylpyridine;(6-tert-butyl-2-pyridinyl)methanol;2-[(6-tert-butyl-2-pyridinyl)oxy]ethanol;2-tert-butyl-6-(3,3,3-trifluoropropyl)pyridine?
The canonical SMILES for 2-tert-butyl-6-ethoxypyridine;2-tert-butyl-6-ethylpyridine;2-tert-butyl-6-methoxy-4-methylpyridine;2-tert-butyl-6-methylpyridine;3-tert-butyl-5-methylpyridine;3-tert-butylpyridine;(6-tert-butyl-2-pyridinyl)methanol;2-[(6-tert-butyl-2-pyridinyl)oxy]ethanol;2-tert-butyl-6-(3,3,3-trifluoropropyl)pyridine is CC(C)(C)c1cccc(CCC(F)(F)F)n1.CC(C)(C)c1cccc(CO)n1.CC(C)(C)c1cccc(OCCO)n1.CC(C)(C)c1cccnc1.CCOc1cccc(C(C)(C)C)n1.CCc1cccc(C(C)(C)C)n1.COc1cc(C)cc(C(C)(C)C)n1.Cc1cccc(C(C)(C)C)n1.Cc1cncc(C(C)(C)C)c1.
What is the InChIKey of 2-tert-butyl-6-ethoxypyridine;2-tert-butyl-6-ethylpyridine;2-tert-butyl-6-methoxy-4-methylpyridine;2-tert-butyl-6-methylpyridine;3-tert-butyl-5-methylpyridine;3-tert-butylpyridine;(6-tert-butyl-2-pyridinyl)methanol;2-[(6-tert-butyl-2-pyridinyl)oxy]ethanol;2-tert-butyl-6-(3,3,3-trifluoropropyl)pyridine?
The InChIKey is MHKIWQVSGWBDAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16F3N.C11H17NO2.2C11H17NO.C11H17N.C10H15NO.2C10H15N.C9H13N/c1-11(2,3)10-6-4-5-9(16-10)7-8-12(13,14)15;1-11(2,3)9-5-4-6-10(12-9)14-8-7-13;1-8-6-9(11(2,3)4)12-10(7-8)13-5;1-5-13-10-8-6-7-9(12-10)11(2,3)4;1-5-9-7-6-8-10(12-9)11(2,3)4;1-10(2,3)9-6-4-5-8(7-12)11-9;1-8-5-9(7-11-6-8)10(2,3)4;1-8-6-5-7-9(11-8)10(2,3)4;1-9(2,3)8-5-4-6-10-7-8/h4-6H,7-8H2,1-3H3;4-6,13H,7-8H2,1-3H3;6-7H,1-5H3;6-8H,5H2,1-4H3;6-8H,5H2,1-4H3;4-6,12H,7H2,1-3H3;2*5-7H,1-4H3;4-7H,1-3H3.
What are the key properties of 2-tert-butyl-6-ethoxypyridine;2-tert-butyl-6-ethylpyridine;2-tert-butyl-6-methoxy-4-methylpyridine;2-tert-butyl-6-methylpyridine;3-tert-butyl-5-methylpyridine;3-tert-butylpyridine;(6-tert-butyl-2-pyridinyl)methanol;2-[(6-tert-butyl-2-pyridinyl)oxy]ethanol;2-tert-butyl-6-(3,3,3-trifluoropropyl)pyridine?
2-tert-butyl-6-ethoxypyridine;2-tert-butyl-6-ethylpyridine;2-tert-butyl-6-methoxy-4-methylpyridine;2-tert-butyl-6-methylpyridine;3-tert-butyl-5-methylpyridine;3-tert-butylpyridine;(6-tert-butyl-2-pyridinyl)methanol;2-[(6-tert-butyl-2-pyridinyl)oxy]ethanol;2-tert-butyl-6-(3,3,3-trifluoropropyl)pyridine has a molecular weight of 1547.23 g/mol, XLogP of 23.67, 10 rotatable bonds, 2 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-6-ethoxypyridine;2-tert-butyl-6-ethylpyridine;2-tert-butyl-6-methoxy-4-methylpyridine;2-tert-butyl-6-methylpyridine;3-tert-butyl-5-methylpyridine;3-tert-butylpyridine;(6-tert-butyl-2-pyridinyl)methanol;2-[(6-tert-butyl-2-pyridinyl)oxy]ethanol;2-tert-butyl-6-(3,3,3-trifluoropropyl)pyridine is sourced from PubChem (CID 159567709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).