ethane;2-methyl-3-propan-2-yloxypyridine

C11H19NO — CID 169127278

IUPACethane;2-methyl-3-propan-2-yloxypyridine
SMILESCC.Cc1ncccc1OC(C)C
InChIInChI=1S/C9H13NO.C2H6/c1-7(2)11-9-5-4-6-10-8(9)3;1-2/h4-7H,1-3H3;1-2H3
InChIKeyTUROROXNZHSBAQ-UHFFFAOYSA-N
MW181.28 g/mol
LogP3.20
Rot. Bonds2

About ethane;2-methyl-3-propan-2-yloxypyridine

ethane;2-methyl-3-propan-2-yloxypyridine (PubChem CID 169127278) has the molecular formula C11H19NO and a molecular weight of 181.28 g/mol. Its IUPAC name is ethane;2-methyl-3-propan-2-yloxypyridine.

Molecular Properties

Compound Nameethane;2-methyl-3-propan-2-yloxypyridine
PubChem CID169127278
Molecular FormulaC11H19NO
Molecular Weight181.28 g/mol
Exact Mass181.15
IUPAC Nameethane;2-methyl-3-propan-2-yloxypyridine
SMILESCC.Cc1ncccc1OC(C)C
InChIInChI=1S/C9H13NO.C2H6/c1-7(2)11-9-5-4-6-10-8(9)3;1-2/h4-7H,1-3H3;1-2H3
InChIKeyTUROROXNZHSBAQ-UHFFFAOYSA-N
XLogP3.20
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.28
LogP ≤ 53.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-methyl-2-propan-2-yloxypyridine
CID 21334096
3-(2,2-dimethylpropoxy)-2-methylpyridine;ethane
CID 143321750
3-(2,2-difluoroethoxy)-2-methylpyridine
CID 131160464
ethane;2-propan-2-yloxypyrimidine
CID 159788973
ethane;2-methyl-3-propan-2-ylpyridine
CID 142858508
(2-methyl-3-pyridinyl) methanesulfonate
CID 119084020
N-methyl-2-[(2-methyl-3-pyridinyl)oxy]pentan-1-amine
CID 83045840
3-propan-2-yloxy-2-(2,2,2-trifluoroethoxy)pyridine
CID 164741273
3-(6-bromohexoxy)-2-methylpyridine
CID 145360692
ethane;2-methyl-3-propan-2-ylpyridine;vanadium
CID 143650392
3-propan-2-yloxy-N-(2-propan-2-yloxyethyl)pyridin-2-amine
CID 113450392
N-(3-methyl-2-propan-2-ylbutyl)-3-propan-2-yloxypyridin-2-amine
CID 102914136

Frequently Asked Questions

What is the IUPAC name of ethane;2-methyl-3-propan-2-yloxypyridine?
The IUPAC name of ethane;2-methyl-3-propan-2-yloxypyridine (CID 169127278) is ethane;2-methyl-3-propan-2-yloxypyridine.
What is the SMILES notation for ethane;2-methyl-3-propan-2-yloxypyridine?
The canonical SMILES for ethane;2-methyl-3-propan-2-yloxypyridine is CC.Cc1ncccc1OC(C)C.
What is the InChIKey of ethane;2-methyl-3-propan-2-yloxypyridine?
The InChIKey is TUROROXNZHSBAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NO.C2H6/c1-7(2)11-9-5-4-6-10-8(9)3;1-2/h4-7H,1-3H3;1-2H3.
What are the key properties of ethane;2-methyl-3-propan-2-yloxypyridine?
ethane;2-methyl-3-propan-2-yloxypyridine has a molecular weight of 181.28 g/mol, XLogP of 3.20, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-methyl-3-propan-2-yloxypyridine is sourced from PubChem (CID 169127278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).