3-chloro-2-propan-2-yloxypyridine

C8H10ClNO — CID 10773509

IUPAC3-chloro-2-propan-2-yloxypyridine
SMILESCC(C)Oc1ncccc1Cl
InChIInChI=1S/C8H10ClNO/c1-6(2)11-8-7(9)4-3-5-10-8/h3-6H,1-2H3
InChIKeyQFEQVJQATJJYFM-UHFFFAOYSA-N
MW171.63 g/mol
LogP2.52
Rot. Bonds2

About 3-chloro-2-propan-2-yloxypyridine

3-chloro-2-propan-2-yloxypyridine (PubChem CID 10773509) has the molecular formula C8H10ClNO and a molecular weight of 171.63 g/mol. Its IUPAC name is 3-chloro-2-propan-2-yloxypyridine.

Molecular Properties

Compound Name3-chloro-2-propan-2-yloxypyridine
PubChem CID10773509
Molecular FormulaC8H10ClNO
Molecular Weight171.63 g/mol
Exact Mass171.05
IUPAC Name3-chloro-2-propan-2-yloxypyridine
SMILESCC(C)Oc1ncccc1Cl
InChIInChI=1S/C8H10ClNO/c1-6(2)11-8-7(9)4-3-5-10-8/h3-6H,1-2H3
InChIKeyQFEQVJQATJJYFM-UHFFFAOYSA-N
XLogP2.52
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 ≤ 52.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-chloro-2-propan-2-yloxypyridine?
The IUPAC name of 3-chloro-2-propan-2-yloxypyridine (CID 10773509) is 3-chloro-2-propan-2-yloxypyridine.
What is the SMILES notation for 3-chloro-2-propan-2-yloxypyridine?
The canonical SMILES for 3-chloro-2-propan-2-yloxypyridine is CC(C)Oc1ncccc1Cl.
What is the InChIKey of 3-chloro-2-propan-2-yloxypyridine?
The InChIKey is QFEQVJQATJJYFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10ClNO/c1-6(2)11-8-7(9)4-3-5-10-8/h3-6H,1-2H3.
What are the key properties of 3-chloro-2-propan-2-yloxypyridine?
3-chloro-2-propan-2-yloxypyridine has a molecular weight of 171.63 g/mol, XLogP of 2.52, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-2-propan-2-yloxypyridine is sourced from PubChem (CID 10773509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).