ethane;2-methoxy-4-(methoxymethyl)pyridine

C12H23NO2 — CID 156724194

IUPACethane;2-methoxy-4-(methoxymethyl)pyridine
SMILESCC.CC.COCc1ccnc(OC)c1
InChIInChI=1S/C8H11NO2.2C2H6/c1-10-6-7-3-4-9-8(5-7)11-2;2*1-2/h3-5H,6H2,1-2H3;2*1-2H3
InChIKeyJHXOJXMXWPWYPK-UHFFFAOYSA-N
MW213.32 g/mol
LogP3.29
Rot. Bonds3

About ethane;2-methoxy-4-(methoxymethyl)pyridine

ethane;2-methoxy-4-(methoxymethyl)pyridine (PubChem CID 156724194) has the molecular formula C12H23NO2 and a molecular weight of 213.32 g/mol. Its IUPAC name is ethane;2-methoxy-4-(methoxymethyl)pyridine.

Molecular Properties

Compound Nameethane;2-methoxy-4-(methoxymethyl)pyridine
PubChem CID156724194
Molecular FormulaC12H23NO2
Molecular Weight213.32 g/mol
Exact Mass213.17
IUPAC Nameethane;2-methoxy-4-(methoxymethyl)pyridine
SMILESCC.CC.COCc1ccnc(OC)c1
InChIInChI=1S/C8H11NO2.2C2H6/c1-10-6-7-3-4-9-8(5-7)11-2;2*1-2/h3-5H,6H2,1-2H3;2*1-2H3
InChIKeyJHXOJXMXWPWYPK-UHFFFAOYSA-N
XLogP3.29
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 53.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(3,5-dimethylphenoxy)methyl]-2-methoxypyridine
CID 141379840
(2-methoxy-4-pyridinyl)methylazanium
CID 25323729
4-(chloromethyl)-2-methoxypyridine;hydrochloride
CID 22625003
ethane;2-fluoro-4-(methoxymethyl)pyridine
CID 169168193
1-(2-methoxy-4-pyridinyl)-N-methylmethanamine;hydrochloride
CID 154963549
(2S)-1-(2-methoxy-4-pyridinyl)propan-2-amine
CID 96849754
N-[2-(2-methoxy-4-pyridinyl)ethyl]-N-propylpropan-1-amine
CID 10376842
2-methoxy-4-(2-pyridin-2-ylethyl)pyridine
CID 59293409
1-[2-(2-methoxy-4-pyridinyl)ethyl]cyclopropan-1-amine
CID 105446410
2-methoxy-4-nitrosopyridine
CID 178043573
N-tert-butyl-4-(methoxymethyl)pyridin-2-amine
CID 58745597
2-methoxy-4-[(4-methoxyphenyl)methoxy]pyridine
CID 70697685

Frequently Asked Questions

What is the IUPAC name of ethane;2-methoxy-4-(methoxymethyl)pyridine?
The IUPAC name of ethane;2-methoxy-4-(methoxymethyl)pyridine (CID 156724194) is ethane;2-methoxy-4-(methoxymethyl)pyridine.
What is the SMILES notation for ethane;2-methoxy-4-(methoxymethyl)pyridine?
The canonical SMILES for ethane;2-methoxy-4-(methoxymethyl)pyridine is CC.CC.COCc1ccnc(OC)c1.
What is the InChIKey of ethane;2-methoxy-4-(methoxymethyl)pyridine?
The InChIKey is JHXOJXMXWPWYPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NO2.2C2H6/c1-10-6-7-3-4-9-8(5-7)11-2;2*1-2/h3-5H,6H2,1-2H3;2*1-2H3.
What are the key properties of ethane;2-methoxy-4-(methoxymethyl)pyridine?
ethane;2-methoxy-4-(methoxymethyl)pyridine has a molecular weight of 213.32 g/mol, XLogP of 3.29, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-methoxy-4-(methoxymethyl)pyridine is sourced from PubChem (CID 156724194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).