3-methyl-2-propan-2-yloxypyridine

C9H13NO — CID 21334096

IUPAC3-methyl-2-propan-2-yloxypyridine
SMILESCc1cccnc1OC(C)C
InChIInChI=1S/C9H13NO/c1-7(2)11-9-8(3)5-4-6-10-9/h4-7H,1-3H3
InChIKeyQLBYWABFKSFKEA-UHFFFAOYSA-N
MW151.21 g/mol
LogP2.18
Rot. Bonds2

About 3-methyl-2-propan-2-yloxypyridine

3-methyl-2-propan-2-yloxypyridine (PubChem CID 21334096) has the molecular formula C9H13NO and a molecular weight of 151.21 g/mol. Its IUPAC name is 3-methyl-2-propan-2-yloxypyridine.

Molecular Properties

Compound Name3-methyl-2-propan-2-yloxypyridine
PubChem CID21334096
Molecular FormulaC9H13NO
Molecular Weight151.21 g/mol
Exact Mass151.10
IUPAC Name3-methyl-2-propan-2-yloxypyridine
SMILESCc1cccnc1OC(C)C
InChIInChI=1S/C9H13NO/c1-7(2)11-9-8(3)5-4-6-10-9/h4-7H,1-3H3
InChIKeyQLBYWABFKSFKEA-UHFFFAOYSA-N
XLogP2.18
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 52.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-2-propan-2-yloxypyridine?
The IUPAC name of 3-methyl-2-propan-2-yloxypyridine (CID 21334096) is 3-methyl-2-propan-2-yloxypyridine.
What is the SMILES notation for 3-methyl-2-propan-2-yloxypyridine?
The canonical SMILES for 3-methyl-2-propan-2-yloxypyridine is Cc1cccnc1OC(C)C.
What is the InChIKey of 3-methyl-2-propan-2-yloxypyridine?
The InChIKey is QLBYWABFKSFKEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NO/c1-7(2)11-9-8(3)5-4-6-10-9/h4-7H,1-3H3.
What are the key properties of 3-methyl-2-propan-2-yloxypyridine?
3-methyl-2-propan-2-yloxypyridine has a molecular weight of 151.21 g/mol, XLogP of 2.18, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-2-propan-2-yloxypyridine is sourced from PubChem (CID 21334096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).