3-chloro-2-ethyl-6-methoxypyridine

C8H10ClNO — CID 123175687

IUPAC3-chloro-2-ethyl-6-methoxypyridine
SMILESCCc1nc(OC)ccc1Cl
InChIInChI=1S/C8H10ClNO/c1-3-7-6(9)4-5-8(10-7)11-2/h4-5H,3H2,1-2H3
InChIKeyGTQCSIWERJSOPQ-UHFFFAOYSA-N
MW171.63 g/mol
LogP2.31
Rot. Bonds2

About 3-chloro-2-ethyl-6-methoxypyridine

3-chloro-2-ethyl-6-methoxypyridine (PubChem CID 123175687) has the molecular formula C8H10ClNO and a molecular weight of 171.63 g/mol. Its IUPAC name is 3-chloro-2-ethyl-6-methoxypyridine.

Molecular Properties

Compound Name3-chloro-2-ethyl-6-methoxypyridine
PubChem CID123175687
Molecular FormulaC8H10ClNO
Molecular Weight171.63 g/mol
Exact Mass171.05
IUPAC Name3-chloro-2-ethyl-6-methoxypyridine
SMILESCCc1nc(OC)ccc1Cl
InChIInChI=1S/C8H10ClNO/c1-3-7-6(9)4-5-8(10-7)11-2/h4-5H,3H2,1-2H3
InChIKeyGTQCSIWERJSOPQ-UHFFFAOYSA-N
XLogP2.31
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 ≤ 52.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-chloro-2-ethyl-6-methoxypyridine?
The IUPAC name of 3-chloro-2-ethyl-6-methoxypyridine (CID 123175687) is 3-chloro-2-ethyl-6-methoxypyridine.
What is the SMILES notation for 3-chloro-2-ethyl-6-methoxypyridine?
The canonical SMILES for 3-chloro-2-ethyl-6-methoxypyridine is CCc1nc(OC)ccc1Cl.
What is the InChIKey of 3-chloro-2-ethyl-6-methoxypyridine?
The InChIKey is GTQCSIWERJSOPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10ClNO/c1-3-7-6(9)4-5-8(10-7)11-2/h4-5H,3H2,1-2H3.
What are the key properties of 3-chloro-2-ethyl-6-methoxypyridine?
3-chloro-2-ethyl-6-methoxypyridine has a molecular weight of 171.63 g/mol, XLogP of 2.31, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-2-ethyl-6-methoxypyridine is sourced from PubChem (CID 123175687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).