6-chloro-3-(methoxymethyl)-2-methylpyridine

C8H10ClNO — CID 155708027

IUPAC6-chloro-3-(methoxymethyl)-2-methylpyridine
SMILESCOCc1ccc(Cl)nc1C
InChIInChI=1S/C8H10ClNO/c1-6-7(5-11-2)3-4-8(9)10-6/h3-4H,5H2,1-2H3
InChIKeyVKAXCDIOSQBRFJ-UHFFFAOYSA-N
MW171.63 g/mol
LogP2.19
Rot. Bonds2

About 6-chloro-3-(methoxymethyl)-2-methylpyridine

6-chloro-3-(methoxymethyl)-2-methylpyridine (PubChem CID 155708027) has the molecular formula C8H10ClNO and a molecular weight of 171.63 g/mol. Its IUPAC name is 6-chloro-3-(methoxymethyl)-2-methylpyridine.

Molecular Properties

Compound Name6-chloro-3-(methoxymethyl)-2-methylpyridine
PubChem CID155708027
Molecular FormulaC8H10ClNO
Molecular Weight171.63 g/mol
Exact Mass171.05
IUPAC Name6-chloro-3-(methoxymethyl)-2-methylpyridine
SMILESCOCc1ccc(Cl)nc1C
InChIInChI=1S/C8H10ClNO/c1-6-7(5-11-2)3-4-8(9)10-6/h3-4H,5H2,1-2H3
InChIKeyVKAXCDIOSQBRFJ-UHFFFAOYSA-N
XLogP2.19
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.63
LogP ≤ 52.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

(2,4-Dichloro-6-methylpyridin-3-yl)methanol
CID 9267100
US10308636, Example 52
CID 55266473
3-(Chloromethyl)-6-methoxy-2-methylpyridine
CID 11206034
2-Chloro-3-(methoxymethyl)pyridine
CID 14012749
2-Chloro-5-(methoxymethyl)pyridine
CID 19010921
(2-Chloro-6-methylpyridin-4-yl)methanol
CID 22504306
Ethyl 6-chloro-2-methylpyridine-3-carboxylate
CID 46221418
[2-Chloro-6-(trifluoromethyl)pyridin-3-yl]methanol
CID 53256696
(2,6-Dichloro-4-methylpyridin-3-yl)methanol
CID 57512862
(6-Chloro-2-methylpyridin-3-yl)methanol
CID 59525984
Methyl 6-chloro-2-methylpyridine-3-carboxylate
CID 59650775
2-chloro-5H,7H,8H-pyrano[4,3-b]pyridine
CID 71743618

Frequently Asked Questions

What is the IUPAC name of 6-chloro-3-(methoxymethyl)-2-methylpyridine?
The IUPAC name of 6-chloro-3-(methoxymethyl)-2-methylpyridine (CID 155708027) is 6-chloro-3-(methoxymethyl)-2-methylpyridine.
What is the SMILES notation for 6-chloro-3-(methoxymethyl)-2-methylpyridine?
The canonical SMILES for 6-chloro-3-(methoxymethyl)-2-methylpyridine is COCc1ccc(Cl)nc1C.
What is the InChIKey of 6-chloro-3-(methoxymethyl)-2-methylpyridine?
The InChIKey is VKAXCDIOSQBRFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10ClNO/c1-6-7(5-11-2)3-4-8(9)10-6/h3-4H,5H2,1-2H3.
What are the key properties of 6-chloro-3-(methoxymethyl)-2-methylpyridine?
6-chloro-3-(methoxymethyl)-2-methylpyridine has a molecular weight of 171.63 g/mol, XLogP of 2.19, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-3-(methoxymethyl)-2-methylpyridine is sourced from PubChem (CID 155708027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).