2-tert-butyl-6-[(1R)-1-methoxyethyl]pyridine

C12H19NO — CID 153483634

IUPAC2-tert-butyl-6-[(1R)-1-methoxyethyl]pyridine
SMILESCO[C@H](C)c1cccc(C(C)(C)C)n1
InChIInChI=1S/C12H19NO/c1-9(14-5)10-7-6-8-11(13-10)12(2,3)4/h6-9H,1-5H3/t9-/m1/s1
InChIKeyDEMRXIFKATZYLJ-SECBINFHSA-N
MW193.29 g/mol
LogP3.09
Rot. Bonds2

About 2-tert-butyl-6-[(1R)-1-methoxyethyl]pyridine

2-tert-butyl-6-[(1R)-1-methoxyethyl]pyridine (PubChem CID 153483634) has the molecular formula C12H19NO and a molecular weight of 193.29 g/mol. Its IUPAC name is 2-tert-butyl-6-[(1R)-1-methoxyethyl]pyridine.

Molecular Properties

Compound Name2-tert-butyl-6-[(1R)-1-methoxyethyl]pyridine
PubChem CID153483634
Molecular FormulaC12H19NO
Molecular Weight193.29 g/mol
Exact Mass193.15
IUPAC Name2-tert-butyl-6-[(1R)-1-methoxyethyl]pyridine
SMILESCO[C@H](C)c1cccc(C(C)(C)C)n1
InChIInChI=1S/C12H19NO/c1-9(14-5)10-7-6-8-11(13-10)12(2,3)4/h6-9H,1-5H3/t9-/m1/s1
InChIKeyDEMRXIFKATZYLJ-SECBINFHSA-N
XLogP3.09
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 53.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(1R)-1-methoxyethyl]-6-propan-2-ylpyridine
CID 142501240
2-(2-methoxypropan-2-yl)-6-propan-2-ylpyridine
CID 170048703
bis(2-tert-butyl-4-propan-2-ylpyridine);tris(2-tert-butyl-6-propan-2-ylpyridine);2-methoxy-6-propan-2-ylpyridine
CID 159786538
O-[[6-(1-methoxyethyl)-2-pyridinyl]methyl]hydroxylamine
CID 69456471
(1S)-2-(tert-butylamino)-1-(6-tert-butyl-2-pyridinyl)ethanol
CID 155154303
1-[6-(trifluoromethyl)-2-pyridinyl]ethyl acetate
CID 174625621
1-tert-butyl-4-(1-methoxyethyl)benzene
CID 15498380
2-tert-butyl-6-(2-iodopropan-2-yl)pyridine
CID 137391001
methyl 2-(6-tert-butyl-2-pyridinyl)acetate
CID 176631988
2-(2-methylpentan-2-yl)-6-propan-2-ylpyridine
CID 129015517
4-(1-methoxyethyl)-2-phenylpyrimidine
CID 141154536
2-[6-(2-hydroxypropan-2-yl)-2-pyridinyl]propanamide
CID 175768787

Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-6-[(1R)-1-methoxyethyl]pyridine?
The IUPAC name of 2-tert-butyl-6-[(1R)-1-methoxyethyl]pyridine (CID 153483634) is 2-tert-butyl-6-[(1R)-1-methoxyethyl]pyridine.
What is the SMILES notation for 2-tert-butyl-6-[(1R)-1-methoxyethyl]pyridine?
The canonical SMILES for 2-tert-butyl-6-[(1R)-1-methoxyethyl]pyridine is CO[C@H](C)c1cccc(C(C)(C)C)n1.
What is the InChIKey of 2-tert-butyl-6-[(1R)-1-methoxyethyl]pyridine?
The InChIKey is DEMRXIFKATZYLJ-SECBINFHSA-N. The full InChI is InChI=1S/C12H19NO/c1-9(14-5)10-7-6-8-11(13-10)12(2,3)4/h6-9H,1-5H3/t9-/m1/s1.
What are the key properties of 2-tert-butyl-6-[(1R)-1-methoxyethyl]pyridine?
2-tert-butyl-6-[(1R)-1-methoxyethyl]pyridine has a molecular weight of 193.29 g/mol, XLogP of 3.09, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-6-[(1R)-1-methoxyethyl]pyridine is sourced from PubChem (CID 153483634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).