3-chloro-1,5-dimethyl-2H-pyridine

C7H10ClN — CID 56622130

IUPAC3-chloro-1,5-dimethyl-2H-pyridine
SMILESCC1=CN(C)CC(Cl)=C1
InChIInChI=1S/C7H10ClN/c1-6-3-7(8)5-9(2)4-6/h3-4H,5H2,1-2H3
InChIKeyPFLALGUAUTVZIY-UHFFFAOYSA-N
MW143.62 g/mol
LogP1.96
Rot. Bonds

About 3-chloro-1,5-dimethyl-2H-pyridine

3-chloro-1,5-dimethyl-2H-pyridine (PubChem CID 56622130) has the molecular formula C7H10ClN and a molecular weight of 143.62 g/mol. Its IUPAC name is 3-chloro-1,5-dimethyl-2H-pyridine.

Molecular Properties

Compound Name3-chloro-1,5-dimethyl-2H-pyridine
PubChem CID56622130
Molecular FormulaC7H10ClN
Molecular Weight143.62 g/mol
Exact Mass143.05
IUPAC Name3-chloro-1,5-dimethyl-2H-pyridine
SMILESCC1=CN(C)CC(Cl)=C1
InChIInChI=1S/C7H10ClN/c1-6-3-7(8)5-9(2)4-6/h3-4H,5H2,1-2H3
InChIKeyPFLALGUAUTVZIY-UHFFFAOYSA-N
XLogP1.96
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.62
LogP ≤ 51.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-chloro-1,5-dimethyl-2H-pyridine?
The IUPAC name of 3-chloro-1,5-dimethyl-2H-pyridine (CID 56622130) is 3-chloro-1,5-dimethyl-2H-pyridine.
What is the SMILES notation for 3-chloro-1,5-dimethyl-2H-pyridine?
The canonical SMILES for 3-chloro-1,5-dimethyl-2H-pyridine is CC1=CN(C)CC(Cl)=C1.
What is the InChIKey of 3-chloro-1,5-dimethyl-2H-pyridine?
The InChIKey is PFLALGUAUTVZIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10ClN/c1-6-3-7(8)5-9(2)4-6/h3-4H,5H2,1-2H3.
What are the key properties of 3-chloro-1,5-dimethyl-2H-pyridine?
3-chloro-1,5-dimethyl-2H-pyridine has a molecular weight of 143.62 g/mol, XLogP of 1.96, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-1,5-dimethyl-2H-pyridine is sourced from PubChem (CID 56622130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).