4-chloro-3-methoxy-2-methylpyridine

C7H8ClNO — CID 10583046

IUPAC4-chloro-3-methoxy-2-methylpyridine
SMILESCOc1c(Cl)ccnc1C
InChIInChI=1S/C7H8ClNO/c1-5-7(10-2)6(8)3-4-9-5/h3-4H,1-2H3
InChIKeyRYGXNMUVOHCPBF-UHFFFAOYSA-N
MW157.60 g/mol
LogP2.05
Rot. Bonds1

About 4-chloro-3-methoxy-2-methylpyridine

4-chloro-3-methoxy-2-methylpyridine (PubChem CID 10583046) has the molecular formula C7H8ClNO and a molecular weight of 157.60 g/mol. Its IUPAC name is 4-chloro-3-methoxy-2-methylpyridine.

Molecular Properties

Compound Name4-chloro-3-methoxy-2-methylpyridine
PubChem CID10583046
Molecular FormulaC7H8ClNO
Molecular Weight157.60 g/mol
Exact Mass157.03
IUPAC Name4-chloro-3-methoxy-2-methylpyridine
SMILESCOc1c(Cl)ccnc1C
InChIInChI=1S/C7H8ClNO/c1-5-7(10-2)6(8)3-4-9-5/h3-4H,1-2H3
InChIKeyRYGXNMUVOHCPBF-UHFFFAOYSA-N
XLogP2.05
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.60
LogP ≤ 52.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-chloro-3-methoxy-2-methylpyridine?
The IUPAC name of 4-chloro-3-methoxy-2-methylpyridine (CID 10583046) is 4-chloro-3-methoxy-2-methylpyridine.
What is the SMILES notation for 4-chloro-3-methoxy-2-methylpyridine?
The canonical SMILES for 4-chloro-3-methoxy-2-methylpyridine is COc1c(Cl)ccnc1C.
What is the InChIKey of 4-chloro-3-methoxy-2-methylpyridine?
The InChIKey is RYGXNMUVOHCPBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8ClNO/c1-5-7(10-2)6(8)3-4-9-5/h3-4H,1-2H3.
What are the key properties of 4-chloro-3-methoxy-2-methylpyridine?
4-chloro-3-methoxy-2-methylpyridine has a molecular weight of 157.60 g/mol, XLogP of 2.05, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-3-methoxy-2-methylpyridine is sourced from PubChem (CID 10583046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).