4-methoxy-2,3-dimethyl-5-propan-2-ylpyridine

C11H17NO — CID 176811168

IUPAC4-methoxy-2,3-dimethyl-5-propan-2-ylpyridine
SMILESCOc1c(C(C)C)cnc(C)c1C
InChIInChI=1S/C11H17NO/c1-7(2)10-6-12-9(4)8(3)11(10)13-5/h6-7H,1-5H3
InChIKeyQADNQOTVRKGUFK-UHFFFAOYSA-N
MW179.26 g/mol
LogP2.83
Rot. Bonds2

About 4-methoxy-2,3-dimethyl-5-propan-2-ylpyridine

4-methoxy-2,3-dimethyl-5-propan-2-ylpyridine (PubChem CID 176811168) has the molecular formula C11H17NO and a molecular weight of 179.26 g/mol. Its IUPAC name is 4-methoxy-2,3-dimethyl-5-propan-2-ylpyridine.

Molecular Properties

Compound Name4-methoxy-2,3-dimethyl-5-propan-2-ylpyridine
PubChem CID176811168
Molecular FormulaC11H17NO
Molecular Weight179.26 g/mol
Exact Mass179.13
IUPAC Name4-methoxy-2,3-dimethyl-5-propan-2-ylpyridine
SMILESCOc1c(C(C)C)cnc(C)c1C
InChIInChI=1S/C11H17NO/c1-7(2)10-6-12-9(4)8(3)11(10)13-5/h6-7H,1-5H3
InChIKeyQADNQOTVRKGUFK-UHFFFAOYSA-N
XLogP2.83
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.26
LogP ≤ 52.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 4-methoxy-2,3-dimethyl-5-propan-2-ylpyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2,3-dimethyl-5-propan-2-ylpyridine?
The IUPAC name of 4-methoxy-2,3-dimethyl-5-propan-2-ylpyridine (CID 176811168) is 4-methoxy-2,3-dimethyl-5-propan-2-ylpyridine.
What is the SMILES notation for 4-methoxy-2,3-dimethyl-5-propan-2-ylpyridine?
The canonical SMILES for 4-methoxy-2,3-dimethyl-5-propan-2-ylpyridine is COc1c(C(C)C)cnc(C)c1C.
What is the InChIKey of 4-methoxy-2,3-dimethyl-5-propan-2-ylpyridine?
The InChIKey is QADNQOTVRKGUFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO/c1-7(2)10-6-12-9(4)8(3)11(10)13-5/h6-7H,1-5H3.
What are the key properties of 4-methoxy-2,3-dimethyl-5-propan-2-ylpyridine?
4-methoxy-2,3-dimethyl-5-propan-2-ylpyridine has a molecular weight of 179.26 g/mol, XLogP of 2.83, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2,3-dimethyl-5-propan-2-ylpyridine is sourced from PubChem (CID 176811168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).